A0A077Z9Y4_TRITR Loading...

2-(3-amino-3-carboxypropyl)histidine synthase subunit 1

Catalyzes the first step of diphthamide biosynthesis, a post-translational modification of histidine which occurs in elongation factor 2.

AlphaFold DB , UniProt , Accession A0A077Z9Y4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 414 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	34.1	Very low	230 Å²	230	157.7 Å²	157.7	100%	1.133	86%	0.856	S	S	*	*				0	134.2	0	-68.2	-174.4	120.8	0	0	106.9
2	P	44.3	Very low	33.7	Very low	121 Å²	121	160.4 Å²	160.4	79%	0.786	86%	0.859	S	S	*	*			cis	-101.5	144.5	19.9	9	14.5	0	0	0	112.8
3	K	35.2	Very low	33.8	Very low	178 Å²	178	163.7 Å²	163.7	77%	0.774	86%	0.861	S	S	*	*				82.7	104.3	78.9	-73.6	-168.8	176.7	-177	0	115.2
4	D	34.4	Very low	33.6	Very low	154 Å²	154	169.1 Å²	169.1	82%	0.824	86%	0.864	S	S	*	*			trans	43	123.7	135	-55.9	-39.1	0	0	0	120.9
5	A	35.6	Very low	33.4	Very low	95 Å²	95	171.1 Å²	171.1	79%	0.785	86%	0.864	S	S	*	*				171.6	132.1	101.7	0	0	0	0	0	113
6	S	35.8	Very low	33.3	Very low	124 Å²	124	172.1 Å²	172.1	87%	0.867	86%	0.864	S	S	*	*			trans	130.1	110	136.3	73.8	0	0	0	0	115.5
7	R	27.7	Very low	33.1	Very low	243 Å²	243	169.1 Å²	169.1	92%	0.917	86%	0.857	S	S	*	*			trans	-70.5	140.9	165.5	-84.5	169.6	156.8	172.7	-6.2	109.8
8	S	34.8	Very low	32.9	Very low	125 Å²	125	169.4 Å²	169.4	87%	0.874	86%	0.857	S	S	*	*			trans	-142.5	132.7	139.4	65.6	0	0	0	0	109.9
9	Q	28.4	Very low	32.8	Very low	172 Å²	172	166.8 Å²	166.8	80%	0.804	85%	0.851	S	S	*	*			trans	-81.6	140.2	-179	-63.6	164.5	-25.4	0	0	109.3
10	T	33.9	Very low	32.6	Very low	133 Å²	133	164.3 Å²	164.3	82%	0.816	84%	0.843	S	S	*	*				-177.7	141.7	125.2	11.7	0	0	0	0	114.2
11	L	32.4	Very low	32.4	Very low	160 Å²	160	163.8 Å²	163.8	84%	0.838	84%	0.842	S	S	*	*			trans	85.8	91.7	150.1	-69.2	152.7	0	0	0	119.4
12	E	29.5	Very low	32.4	Very low	190 Å²	190	157.8 Å²	157.8	89%	0.888	82%	0.818	S	S	*	*			trans	-50.9	129.4	152.6	-71.7	172.7	123	0	0	112.4
13	K	34.3	Very low	31.7	Very low	203 Å²	203	157.7 Å²	157.7	88%	0.883	82%	0.818	S	S	*	*			trans	-132.4	119.7	147.2	-87.5	-173.2	178.1	177.9	0	109.5	K15	K13-K15 PolarHBondContact O-N 3.38Å
14	R	30.8	Very low	31.4	Very low	240 Å²	240	158 Å²	158	91%	0.906	81%	0.814	S	S	*	*			trans	-42.7	123.5	176.8	-69.6	171.6	169	-178.5	-4.8	112.2
15	K	31.3	Very low	31.4	Very low	199 Å²	199	159.8 Å²	159.8	87%	0.865	82%	0.818	S	S	*	*			trans	-97.4	105.1	158.1	-79.5	-175.4	175.8	-178.5	0	108.2	K13	K13-K15 PolarHBondContact O-N 3.38Å
16	Q	31.4	Very low	31.4	Very low	186 Å²	186	163.6 Å²	163.6	87%	0.869	82%	0.816	S	S	*	*			trans	-76.8	118.1	164.8	-89.8	170.9	-31.7	0	0	108.7
17	T	29.5	Very low	31.5	Very low	122 Å²	122	161.6 Å²	161.6	75%	0.748	80%	0.803	S	S	*	*			trans	-98.7	113.1	171.7	-50.6	0	0	0	0	107.5	V19	T17-V19 HydrophobicContact CG2-CG2 4.37Å
18	M	30.5	Very low	32.1	Very low	174 Å²	174	153.3 Å²	153.3	86%	0.857	78%	0.779	S	S	*	*			trans	-100.9	124.2	166.6	-80.6	-174.9	63.3	0	0	108.7
19	V	29.7	Very low	32.6	Very low	121 Å²	121	149.9 Å²	149.9	73%	0.733	76%	0.755	S	S	*	*			trans	-99.6	118.3	177.2	179.2	0	0	0	0	107.7	T17	T17-V19 HydrophobicContact CG2-CG2 4.37Å
20	V	30.1	Very low	33.1	Very low	115 Å²	115	150.5 Å²	150.5	70%	0.697	76%	0.755	S	S	*	*			trans	-110	122.8	169.6	-175.3	0	0	0	0	107.9	V22	V20-V22 HydrophobicContact CG1-CG2 4.02Å
21	N	28.9	Very low	33.4	Very low	154 Å²	154	151.3 Å²	151.3	82%	0.824	75%	0.749	S	S	*	*			trans	-89.3	121	173	-88.3	-20.3	0	0	0	109.1
22	V	31.7	Very low	34	Very low	104 Å²	104	145.6 Å²	145.6	63%	0.63	72%	0.719	S	S	*	*			trans	-127.5	138.7	169.9	-172.6	0	0	0	0	108.8	V20	V20-V22 HydrophobicContact CG1-CG2 4.02Å
23	P	29.7	Very low	34.5	Very low	119 Å²	119	144.3 Å²	144.3	77%	0.773	71%	0.706	S	S	*	*			trans	-64.8	142.4	-174.4	-17.4	30.8	0	0	0	113.2	E25	P23-E25 PolarHBondContact O-N 3.43Å
24	R	29.1	Very low	35.1	Very low	186 Å²	186	144 Å²	144	70%	0.702	70%	0.699	S	S	*	*			trans	-71.9	111.5	176.4	-79.3	174.9	165.2	176.7	-6	111.2
25	E	35.5	Very low	36.2	Very low	191 Å²	191	135.1 Å²	135.1	89%	0.893	67%	0.669	S	S	*	*			trans	-95.9	131.5	158.4	-77.2	-169.3	161.4	0	0	110.8	P23	P23-E25 PolarHBondContact O-N 3.43Å
26	K	35.5	Very low	37.5	Very low	174 Å²	174	129.3 Å²	129.3	76%	0.757	65%	0.65	S	S	*	*			trans	-89.5	109.3	-176.7	-70.4	176.3	179.4	172.1	0	110.5	T28	K26-T28 PolarHBondContact O-N 3.11Å
27	S	37.2	Very low	38.9	Very low	83 Å²	83	124.8 Å²	124.8	58%	0.58	64%	0.639	S	S	*	*			trans	-87.5	97.8	165.3	69.9	0	0	0	0	110.7
28	T	39.6	Very low	41.4	Very low	69 Å²	69	127.7 Å²	127.7	42%	0.423	64%	0.636	S	S	.	*			trans	-82.4	132.8	168.5	46.7	0	0	0	0	110.4	K26	K26-T28 PolarHBondContact O-N 3.11Å
29	S	46.4	Very low	44.2	Very low	53 Å²	53	120 Å²	120	37%	0.371	60%	0.598	S	S	.	*			trans	-67.4	150.8	-178.5	71.5	0	0	0	0	111.4	E31 Q32 R33	S29-E31 PolarHBondContact O-N 3.16Å; S29-Q32 PolarHBondContact O-N 2.77Å; S29-Q32 VanDerWaalsContact O-N 3.1Å; S29-R33 PolarHBondContact O-N 2.74Å
30	K	38.3	Very low	47.2	Very low	184 Å²	184	116.3 Å²	116.3	80%	0.8	58%	0.576	S	S	*	*	H	α-helix	trans	-53.6	-26.8	-177.1	-85.3	-179.7	176.4	174.9	0	114.2	R34	K30-R34 PolarHBondContact O-N 3.43Å
31	E	40.8	Very low	50.1	Low	150 Å²	150	114.9 Å²	114.9	70%	0.701	57%	0.568	S	S	*	*	H	α-helix	trans	-77.7	-38.7	-178.9	-165.1	151.6	-163.2	0	0	112.3	S29 R33 R34 I35	S29-E31 PolarHBondContact O-N 3.16Å; E31-R33 VanDerWaalsContact C-N 3.28Å; E31-R33 PolarHBondContact O-N 3.02Å; E31-R34 PolarHBondContact O-N 2.97Å; E31-I35 PolarHBondContact O-N 3.23Å
32	Q	43.6	Very low	53.2	Low	41 Å²	41	114.3 Å²	114.3	19%	0.192	56%	0.56	C	S	.	*	H	α-helix	trans	-58.8	-41.2	169.7	-76.2	170.6	-16.7	0	0	110.9	S29 R34 I35 V36	S29-Q32 PolarHBondContact O-N 2.77Å; S29-Q32 VanDerWaalsContact O-N 3.1Å; Q32-R34 VanDerWaalsContact C-N 3.32Å; Q32-R34 PolarHBondContact O-N 3.04Å; Q32-I35 PolarHBondContact O-N 3.03Å; Q32-V36 WeakPolarHBondContact O-CB 3.29Å; Q32-V36 VanDerWaalsContact O-CG2 3.26Å; Q32-V36 WeakPolarHBondContact O-CG2 3.45Å; Q32-V36 PolarHBondContact O-N 2.79Å
33	R	40.4	Very low	56.1	Low	163 Å²	163	109.4 Å²	109.4	62%	0.615	53%	0.531	S	S	*	.	H	α-helix	trans	-60	-37.5	177.1	-69	-173.5	-176.6	-177.7	-0.7	113.3	S29 E31 S37	S29-R33 PolarHBondContact O-N 2.74Å; E31-R33 VanDerWaalsContact C-N 3.28Å; E31-R33 PolarHBondContact O-N 3.02Å; R33-S37 WeakPolarHBondContact O-CB 3.43Å; R33-S37 PolarHBondContact O-N 3.11Å; R33-S37 PolarHBondContact O-OG 2.96Å
34	R	47	Very low	59.2	Low	196 Å²	196	106 Å²	106	74%	0.74	51%	0.506	S	S	*	.	H	α-helix	trans	-71.7	-28.6	179.6	-80.5	-174.8	172.7	-179.4	-1.9	113.9	K30 E31 Q32 S37	K30-R34 PolarHBondContact O-N 3.43Å; E31-R34 PolarHBondContact O-N 2.97Å; Q32-R34 VanDerWaalsContact C-N 3.32Å; Q32-R34 PolarHBondContact O-N 3.04Å; R34-S37 WeakPolarHBondContact CA-OG 3.49Å; R34-S37 PolarHBondContact O-OG 3.44Å
35	I	53.7	Low	62.3	Low	54 Å²	54	103.4 Å²	103.4	28%	0.277	50%	0.501	S	S	.	.	H	α-helix	trans	-82.4	-44.5	177	-62.6	174.6	0	0	0	109.6	E31 Q32 S37 R38 I39 K66	E31-I35 PolarHBondContact O-N 3.23Å; Q32-I35 PolarHBondContact O-N 3.03Å; I35-S37 PolarHBondContact O-N 3.15Å; I35-R38 PolarHBondContact O-N 2.88Å; I35-I39 PolarHBondContact O-N 3.37Å; I35-K66 HydrophobicContact CG2-CD 3.91Å; I35-K66 HydrophobicContact CG2-CG 3.92Å
36	V	59.2	Low	65.1	Low	76 Å²	76	96.3 Å²	96.3	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-56.4	-37.3	174.3	175.1	0	0	0	0	110.6	Q32 R38 I39 L44	Q32-V36 WeakPolarHBondContact O-CB 3.29Å; Q32-V36 VanDerWaalsContact O-CG2 3.26Å; Q32-V36 WeakPolarHBondContact O-CG2 3.45Å; Q32-V36 PolarHBondContact O-N 2.79Å; V36-R38 PolarHBondContact O-N 3.12Å; V36-R38 VanDerWaalsContact O-N 3.09Å; V36-I39 PolarHBondContact O-N 3.07Å; V36-L44 HydrophobicContact CG1-CD1 4.27Å
37	S	61.7	Low	68.1	Low	91 Å²	91	94.1 Å²	94.1	64%	0.636	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-9.3	176.6	67.6	0	0	0	0	115.2	R33 R34 I35	R33-S37 WeakPolarHBondContact O-CB 3.43Å; R33-S37 PolarHBondContact O-N 3.11Å; R33-S37 PolarHBondContact O-OG 2.96Å; R34-S37 WeakPolarHBondContact CA-OG 3.49Å; R34-S37 PolarHBondContact O-OG 3.44Å; I35-S37 PolarHBondContact O-N 3.15Å
38	R	80.9	Confident	70.9	Confident	184 Å²	184	97.5 Å²	97.5	69%	0.694	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-13.3	176.8	-66.7	-175.1	177.1	-171.7	-1.8	113.5	I35 V36 P40 W69	I35-R38 PolarHBondContact O-N 2.88Å; V36-R38 PolarHBondContact O-N 3.12Å; V36-R38 VanDerWaalsContact O-N 3.09Å; R38-P40 WeakPolarHBondContact O-CD 3.41Å; R38-W69 HydrophobicContact CB-CH2 3.5Å; R38-W69 HydrophobicContact CB-CZ2 3.87Å; R38-W69 HydrophobicContact CB-CZ3 4.12Å; R38-W69 HydrophobicContact CG-CH2 4.48Å; R38-W69 WeakPolarHBondContact O-CZ2 3.49Å
39	I	90	Very high	73.7	Confident	12 Å²	12	94.2 Å²	94.2	6%	0.062	45%	0.446	C	S	.	.	S	Bend	trans	-75.9	123.5	176.6	-59.4	172.4	0	0	0	107.5	I35 V36 V41 I43 L44 F65 K66 W69	I35-I39 PolarHBondContact O-N 3.37Å; V36-I39 PolarHBondContact O-N 3.07Å; I39-V41 PolarHBondContact O-N 3Å; I39-I43 HydrophobicContact CG2-CB 3.98Å; I39-I43 HydrophobicContact CG2-CG2 3.93Å; I39-L44 HydrophobicContact CB-CD1 4.27Å; I39-L44 HydrophobicContact CB-CD2 4.26Å; I39-L44 HydrophobicContact CB-CG 4.2Å; I39-L44 HydrophobicContact CD1-CD2 4.43Å; I39-L44 HydrophobicContact CG2-CD1 4.38Å; I39-L44 HydrophobicContact CG2-CD2 3.88Å; I39-L44 HydrophobicContact CG2-CG 3.78Å; I39-F65 HydrophobicContact CD1-CB 4.19Å; I39-K66 HydrophobicContact CD1-CB 4.01Å; I39-W69 HydrophobicContact CG1-CB 4.34Å; I39-W69 HydrophobicContact CG1-CD2 4.2Å; I39-W69 HydrophobicContact CG1-CE3 3.97Å; I39-W69 HydrophobicContact CG1-CG 4.37Å; I39-W69 HydrophobicContact CG2-CB 4.19Å; I39-W69 HydrophobicContact CG2-CG 4.5Å
40	P	91.5	Very high	76.1	Confident	43 Å²	43	95.2 Å²	95.2	28%	0.279	44%	0.444	S	S	.	.			trans	-51.7	137.9	175.7	-30.2	37.1	0	0	0	112.4	R38 E42 I43 L44	R38-P40 WeakPolarHBondContact O-CD 3.41Å; P40-E42 HydrophobicContact CB-CG 3.63Å; P40-E42 PolarHBondContact O-N 3.3Å; P40-I43 HydrophobicContact CG-CD1 4.41Å; P40-I43 PolarHBondContact O-N 2.89Å; P40-L44 PolarHBondContact O-N 3.46Å
41	V	91.6	Very high	78.9	Confident	86 Å²	86	89.4 Å²	89.4	52%	0.521	43%	0.43	S	S	.	.	H	α-helix	trans	-57.5	-35.7	179.8	178.6	0	0	0	0	111.1	I39 I43 L44 E45	I39-V41 PolarHBondContact O-N 3Å; V41-I43 PolarHBondContact O-N 3.27Å; V41-I43 VanDerWaalsContact O-N 3.17Å; V41-L44 PolarHBondContact O-N 3.15Å; V41-E45 HydrophobicContact CG1-CB 4.37Å; V41-E45 HydrophobicContact CG1-CG 3.7Å; V41-E45 WeakPolarHBondContact CG1-OE1 3.35Å; V41-E45 WeakPolarHBondContact CG1-OE2 3.26Å; V41-E45 WeakPolarHBondContact O-CB 3.34Å; V41-E45 PolarHBondContact O-N 3.25Å
42	E	92.9	Very high	81.6	Confident	141 Å²	141	83 Å²	83	66%	0.659	40%	0.403	S	S	*	.	H	α-helix	trans	-55.5	-29.8	174	66.1	-168.2	-159.6	0	0	114.1	P40	P40-E42 HydrophobicContact CB-CG 3.63Å; P40-E42 PolarHBondContact O-N 3.3Å
43	I	94.2	Very high	84.1	Confident	2 Å²	2	82.8 Å²	82.8	1%	0.01	40%	0.403	C	S	.	.	H	α-helix	trans	-83.2	-40.5	175	-66	175.7	0	0	0	110.1	I39 P40 V41 L49 F65 I68 W69	I39-I43 HydrophobicContact CG2-CB 3.98Å; I39-I43 HydrophobicContact CG2-CG2 3.93Å; P40-I43 HydrophobicContact CG-CD1 4.41Å; P40-I43 PolarHBondContact O-N 2.89Å; V41-I43 PolarHBondContact O-N 3.27Å; V41-I43 VanDerWaalsContact O-N 3.17Å; I43-L49 HydrophobicContact CG2-CD2 4.09Å; I43-F65 HydrophobicContact CG2-CB 4.25Å; I43-F65 HydrophobicContact CG2-CD1 3.89Å; I43-F65 WeakPolarHBondContact O-CD1 3.32Å; I43-F65 VanDerWaalsContact O-CE1 3.31Å; I43-F65 WeakPolarHBondContact O-CE1 3.34Å; I43-I68 HydrophobicContact CD1-CG2 4.35Å; I43-I68 HydrophobicContact CG2-CG2 4.39Å; I43-W69 HydrophobicContact CD1-CB 3.92Å; I43-W69 HydrophobicContact CD1-CG 4.47Å
44	L	93.7	Very high	86.8	Confident	48 Å²	48	78.9 Å²	78.9	25%	0.251	41%	0.405	S	S	.	.	H	α-helix	trans	-71.3	-30.1	-178.1	-66.6	173.8	0	0	0	113	V36 I39 P40 V41 K50 F65	V36-L44 HydrophobicContact CG1-CD1 4.27Å; I39-L44 HydrophobicContact CB-CD1 4.27Å; I39-L44 HydrophobicContact CB-CD2 4.26Å; I39-L44 HydrophobicContact CB-CG 4.2Å; I39-L44 HydrophobicContact CD1-CD2 4.43Å; I39-L44 HydrophobicContact CG2-CD1 4.38Å; I39-L44 HydrophobicContact CG2-CD2 3.88Å; I39-L44 HydrophobicContact CG2-CG 3.78Å; P40-L44 PolarHBondContact O-N 3.46Å; V41-L44 PolarHBondContact O-N 3.15Å; L44-K50 WeakPolarHBondContact O-CE 3.42Å; L44-F65 HydrophobicContact CD2-CB 4.1Å; L44-F65 HydrophobicContact CD2-CD1 4.39Å; L44-F65 HydrophobicContact CD2-CD2 4.43Å; L44-F65 HydrophobicContact CD2-CG 4.08Å
45	E	93.9	Very high	89.1	Confident	130 Å²	130	75 Å²	75	61%	0.607	40%	0.399	S	S	*	.	S	Bend	trans	-101.3	3.2	-177	-66	-174.9	174.6	0	0	113.6	V41 E47	V41-E45 HydrophobicContact CG1-CB 4.37Å; V41-E45 HydrophobicContact CG1-CG 3.7Å; V41-E45 WeakPolarHBondContact CG1-OE1 3.35Å; V41-E45 WeakPolarHBondContact CG1-OE2 3.26Å; V41-E45 WeakPolarHBondContact O-CB 3.34Å; V41-E45 PolarHBondContact O-N 3.25Å; E45-E47 PolarHBondContact O-N 3.43Å
46	D	96	Very high	91.2	Very high	43 Å²	43	73 Å²	73	23%	0.23	39%	0.389	C	S	.	.			trans	-65.7	107.1	174.3	-174.4	-28.3	0	0	0	110.7	K48 L49 K50	D46-K48 VanDerWaalsContact C-N 3.31Å; D46-K48 PolarHBondContact O-N 3.01Å; D46-K48 WeakPolarHBondContact OD1-CA 3.27Å; D46-K48 WeakPolarHBondContact OD1-CB 3.29Å; D46-K48 PolarHBondContact OD1-N 2.68Å; D46-L49 HydrophobicContact CB-CB 3.81Å; D46-L49 PolarHBondContact O-N 3.33Å; D46-L49 PolarHBondContact OD1-N 2.91Å; D46-K50 WeakPolarHBondContact O-CG 3.18Å; D46-K50 PolarHBondContact O-N 2.83Å
47	E	96.9	Very high	92.9	Very high	127 Å²	127	71 Å²	71	59%	0.593	38%	0.378	S	S	*	.	H	α-helix	trans	-65.3	-31.8	-178	-66.3	-55.7	130.6	0	0	113.2	E45 K50 A51	E45-E47 PolarHBondContact O-N 3.43Å; E47-K50 IonicContact OE1-NZ 3.03Å; E47-K50 PolarHBondContact OE1-NZ 3.46Å; E47-A51 WeakPolarHBondContact O-CB 3.43Å; E47-A51 PolarHBondContact O-N 3.38Å
48	K	97.1	Very high	94.4	Very high	154 Å²	154	71.9 Å²	71.9	67%	0.67	38%	0.375	S	S	*	.	H	α-helix	trans	-70.2	-42.6	176	-67.4	-176.2	178.1	-176.3	0	110.2	D46 A51 A52 F101	D46-K48 VanDerWaalsContact C-N 3.31Å; D46-K48 PolarHBondContact O-N 3.01Å; D46-K48 WeakPolarHBondContact OD1-CA 3.27Å; D46-K48 WeakPolarHBondContact OD1-CB 3.29Å; D46-K48 PolarHBondContact OD1-N 2.68Å; K48-A51 PolarHBondContact O-N 3.44Å; K48-A52 PolarHBondContact O-N 3.19Å; K48-F101 HydrophobicContact CB-CE1 3.81Å; K48-F101 HydrophobicContact CB-CZ 3.89Å
49	L	97.7	Very high	94.9	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-63.4	-43.8	176.6	177.9	54.4	0	0	0	111.5	I43 D46 A51 A52 I53 I64 F65 I68 I97 F101	I43-L49 HydrophobicContact CG2-CD2 4.09Å; D46-L49 HydrophobicContact CB-CB 3.81Å; D46-L49 PolarHBondContact O-N 3.33Å; D46-L49 PolarHBondContact OD1-N 2.91Å; L49-A51 VanDerWaalsContact C-N 3.33Å; L49-A51 PolarHBondContact O-N 3.03Å; L49-A52 PolarHBondContact O-N 3.03Å; L49-I53 HydrophobicContact CD1-CD1 3.75Å; L49-I53 HydrophobicContact CD1-CG1 4Å; L49-I53 HydrophobicContact CG-CD1 3.81Å; L49-I53 HydrophobicContact CG-CG1 4.47Å; L49-I53 WeakPolarHBondContact O-CB 3.47Å; L49-I53 VanDerWaalsContact O-CG1 3.3Å; L49-I53 WeakPolarHBondContact O-CG1 3.38Å; L49-I53 PolarHBondContact O-N 2.98Å; L49-I64 HydrophobicContact CD1-CG2 4.33Å; L49-F65 HydrophobicContact CD2-CD1 3.55Å; L49-F65 HydrophobicContact CD2-CE1 3.58Å; L49-F65 HydrophobicContact CG-CD1 4.2Å; L49-F65 HydrophobicContact CG-CE1 3.79Å; L49-I68 HydrophobicContact CD1-CD1 3.44Å; L49-I68 VanDerWaalsContact CD1-CD1 3.44Å; L49-I68 HydrophobicContact CD2-CD1 3.56Å; L49-I68 HydrophobicContact CG-CD1 4.16Å; L49-I97 HydrophobicContact CD1-CG2 3.63Å; L49-F101 HydrophobicContact CB-CD1 3.74Å; L49-F101 HydrophobicContact CB-CE1 3.67Å; L49-F101 HydrophobicContact CB-CG 4.28Å; L49-F101 HydrophobicContact CB-CZ 4.16Å; L49-F101 HydrophobicContact CD1-CB 4.16Å; L49-F101 HydrophobicContact CD1-CD1 4.12Å; L49-F101 HydrophobicContact CD1-CD2 3.82Å; L49-F101 HydrophobicContact CD1-CE2 4.24Å; L49-F101 HydrophobicContact CD1-CG 3.76Å; L49-F101 HydrophobicContact CG-CD1 4.36Å; L49-F101 HydrophobicContact CG-CG 4.46Å; L49-F101 VanDerWaalsContact N-CE1 3.33Å
50	K	97.1	Very high	95.2	Very high	75 Å²	75	67.1 Å²	67.1	33%	0.326	36%	0.361	S	S	.	.	H	α-helix	trans	-58.7	-43.9	174.6	-72.4	173.9	-169.5	168.1	0	111.9	L44 D46 E47 I53 A54 F65	L44-K50 WeakPolarHBondContact O-CE 3.42Å; D46-K50 WeakPolarHBondContact O-CG 3.18Å; D46-K50 PolarHBondContact O-N 2.83Å; E47-K50 IonicContact OE1-NZ 3.03Å; E47-K50 PolarHBondContact OE1-NZ 3.46Å; K50-I53 PolarHBondContact O-N 3.42Å; K50-A54 PolarHBondContact O-N 3.02Å; K50-F65 HydrophobicContact CG-CZ 4.12Å
51	A	97.3	Very high	95.4	Very high	62 Å²	62	67.5 Å²	67.5	51%	0.512	36%	0.361	S	S	.	.	H	α-helix	trans	-63.9	-39.9	177.4	0	0	0	0	0	112	E47 K48 L49 A54 N55	E47-A51 WeakPolarHBondContact O-CB 3.43Å; E47-A51 PolarHBondContact O-N 3.38Å; K48-A51 PolarHBondContact O-N 3.44Å; L49-A51 VanDerWaalsContact C-N 3.33Å; L49-A51 PolarHBondContact O-N 3.03Å; A51-A54 WeakPolarHBondContact O-CB 3.36Å; A51-A54 PolarHBondContact O-N 3.43Å; A51-N55 PolarHBondContact O-ND2 3.17Å
52	A	97.3	Very high	95.6	Very high	16 Å²	16	63.7 Å²	63.7	13%	0.132	34%	0.338	C	S	.	.	H	α-helix	trans	-65.9	-46	176.3	0	0	0	0	0	111.7	K48 L49 A54 N55 I97 F101	K48-A52 PolarHBondContact O-N 3.19Å; L49-A52 PolarHBondContact O-N 3.03Å; A52-A54 PolarHBondContact O-N 3.11Å; A52-N55 WeakPolarHBondContact O-CB 3.37Å; A52-N55 PolarHBondContact O-N 3.47Å; A52-N55 VanDerWaalsContact O-N 3.14Å; A52-N55 PolarHBondContact O-ND2 3Å; A52-I97 HydrophobicContact CB-CD1 4.28Å; A52-I97 HydrophobicContact CB-CG1 3.92Å; A52-F101 HydrophobicContact CB-CE2 3.87Å; A52-F101 HydrophobicContact CB-CZ 4.3Å
53	I	97	Very high	95.8	Very high	36 Å²	36	58.9 Å²	58.9	19%	0.185	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-30	176.1	-69.2	168.3	0	0	0	112	L49 K50 N55 L56 I64 F65 I97	L49-I53 HydrophobicContact CD1-CD1 3.75Å; L49-I53 HydrophobicContact CD1-CG1 4Å; L49-I53 HydrophobicContact CG-CD1 3.81Å; L49-I53 HydrophobicContact CG-CG1 4.47Å; L49-I53 WeakPolarHBondContact O-CB 3.47Å; L49-I53 VanDerWaalsContact O-CG1 3.3Å; L49-I53 WeakPolarHBondContact O-CG1 3.38Å; L49-I53 PolarHBondContact O-N 2.98Å; K50-I53 PolarHBondContact O-N 3.42Å; I53-N55 PolarHBondContact O-N 3.33Å; I53-N55 VanDerWaalsContact O-N 3.1Å; I53-L56 WeakPolarHBondContact O-CB 2.87Å; I53-L56 PolarHBondContact O-N 3.02Å; I53-I64 HydrophobicContact CD1-CB 3.81Å; I53-I64 HydrophobicContact CD1-CG1 4.5Å; I53-I64 HydrophobicContact CD1-CG2 3.76Å; I53-I64 HydrophobicContact CG1-CB 4.06Å; I53-I64 HydrophobicContact CG1-CG1 4.27Å; I53-I64 HydrophobicContact CG1-CG2 3.88Å; I53-F65 HydrophobicContact CD1-CD1 4.2Å; I53-F65 HydrophobicContact CD1-CD2 4.16Å; I53-F65 HydrophobicContact CD1-CE1 3.76Å; I53-F65 HydrophobicContact CD1-CE2 3.7Å; I53-F65 HydrophobicContact CD1-CG 4.39Å; I53-F65 HydrophobicContact CD1-CZ 3.49Å; I53-F65 VanDerWaalsContact CD1-CZ 3.49Å; I53-I97 HydrophobicContact CG1-CD1 4.47Å
54	A	96.4	Very high	96	Very high	80 Å²	80	59 Å²	59	66%	0.661	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.8	178	0	0	0	0	0	114.1	K50 A51 A52 L56	K50-A54 PolarHBondContact O-N 3.02Å; A51-A54 WeakPolarHBondContact O-CB 3.36Å; A51-A54 PolarHBondContact O-N 3.43Å; A52-A54 PolarHBondContact O-N 3.11Å; A54-L56 VanDerWaalsContact C-N 3.28Å
55	N	95.5	Very high	96.1	Very high	116 Å²	116	59.2 Å²	59.2	62%	0.62	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-13.7	170.4	-62	-74.6	0	0	0	113.2	A51 A52 I53 I93	A51-N55 PolarHBondContact O-ND2 3.17Å; A52-N55 WeakPolarHBondContact O-CB 3.37Å; A52-N55 PolarHBondContact O-N 3.47Å; A52-N55 VanDerWaalsContact O-N 3.14Å; A52-N55 PolarHBondContact O-ND2 3Å; I53-N55 PolarHBondContact O-N 3.33Å; I53-N55 VanDerWaalsContact O-N 3.1Å; N55-I93 HydrophobicContact CB-CG2 4.36Å
56	L	96.7	Very high	96.2	Very high	11 Å²	11	54.9 Å²	54.9	6%	0.058	29%	0.294	C	S	.	.	S	Bend	trans	-88.1	148.1	172.7	-62.3	170.5	0	0	0	110	I53 A54 D58 F62 I64 F90 I93 I94 I97	I53-L56 WeakPolarHBondContact O-CB 2.87Å; I53-L56 PolarHBondContact O-N 3.02Å; A54-L56 VanDerWaalsContact C-N 3.28Å; L56-D58 PolarHBondContact O-N 3.38Å; L56-F62 HydrophobicContact CB-CD2 4.13Å; L56-F62 HydrophobicContact CB-CE2 4.13Å; L56-F62 HydrophobicContact CD1-CD2 3.94Å; L56-F62 HydrophobicContact CD1-CG 4.47Å; L56-F62 HydrophobicContact CD2-CE2 4.36Å; L56-F62 HydrophobicContact CG-CD2 4.44Å; L56-I64 HydrophobicContact CD1-CD1 4.17Å; L56-I64 HydrophobicContact CD1-CG1 4Å; L56-F90 HydrophobicContact CD2-CB 4.05Å; L56-F90 HydrophobicContact CD2-CD1 4.28Å; L56-F90 HydrophobicContact CD2-CG 4.45Å; L56-I93 HydrophobicContact CD2-CB 4.1Å; L56-I93 HydrophobicContact CD2-CG2 3.76Å; L56-I93 HydrophobicContact CG-CG2 4.11Å; L56-I94 HydrophobicContact CD1-CG1 3.95Å; L56-I94 HydrophobicContact CD2-CD1 4.46Å; L56-I94 HydrophobicContact CD2-CG1 3.96Å; L56-I97 HydrophobicContact CD1-CD1 4.15Å
57	P	94.8	Very high	96.3	Very high	35 Å²	35	52.9 Å²	52.9	23%	0.227	28%	0.283	C	S	.	.			trans	-62	126.1	179.2	26.2	-36.9	0	0	0	112	T59 Y60 F62 F90	P57-T59 PolarHBondContact O-N 2.94Å; P57-T59 VanDerWaalsContact O-N 3.14Å; P57-Y60 HydrophobicContact CB-CD2 3.71Å; P57-Y60 HydrophobicContact CB-CE2 4.18Å; P57-Y60 HydrophobicContact CG-CD2 3.39Å; P57-Y60 HydrophobicContact CG-CE2 3.97Å; P57-Y60 HydrophobicContact CG-CG 4.3Å; P57-Y60 PolarHBondContact O-N 3.5Å; P57-Y60 VanDerWaalsContact O-N 3.11Å; P57-F62 HydrophobicContact CG-CE2 4.08Å; P57-F90 VanDerWaalsContact CD-CE1 3.48Å; P57-F90 HydrophobicContact CG-CD1 4.29Å; P57-F90 HydrophobicContact CG-CE1 3.63Å; P57-F90 HydrophobicContact CG-CE2 4.25Å; P57-F90 HydrophobicContact CG-CZ 3.61Å
58	D	93.3	Very high	96.4	Very high	109 Å²	109	46.8 Å²	46.8	58%	0.583	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.9	-174.5	77.3	-30.1	0	0	0	114.3	L56 Y60 K159	L56-D58 PolarHBondContact O-N 3.38Å; D58-Y60 VanDerWaalsContact C-N 3.32Å; D58-K159 PolarHBondContact O-NZ 2.74Å
59	T	92.9	Very high	96.4	Very high	40 Å²	40	41.5 Å²	41.5	25%	0.245	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-27.3	174.7	52.3	0	0	0	0	112.5	P57 I158 K159	P57-T59 PolarHBondContact O-N 2.94Å; P57-T59 VanDerWaalsContact O-N 3.14Å; T59-I158 WeakPolarHBondContact O-CA 3.35Å; T59-K159 PolarHBondContact O-N 3.43Å
60	Y	95.3	Very high	96.3	Very high	55 Å²	55	43.9 Å²	43.9	22%	0.216	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134.4	-178.7	-61.8	-89.2	0	0	0	110.5	P57 D58 F62 L87 V156 I158 Y260	P57-Y60 HydrophobicContact CB-CD2 3.71Å; P57-Y60 HydrophobicContact CB-CE2 4.18Å; P57-Y60 HydrophobicContact CG-CD2 3.39Å; P57-Y60 HydrophobicContact CG-CE2 3.97Å; P57-Y60 HydrophobicContact CG-CG 4.3Å; P57-Y60 PolarHBondContact O-N 3.5Å; P57-Y60 VanDerWaalsContact O-N 3.11Å; D58-Y60 VanDerWaalsContact C-N 3.32Å; Y60-F62 HydrophobicContact CG-CE2 4.41Å; Y60-F62 HydrophobicContact CG-CZ 4.32Å; Y60-L87 HydrophobicContact CD1-CD2 4.28Å; Y60-L87 HydrophobicContact CE1-CD2 4.21Å; Y60-V156 HydrophobicContact CD1-CG1 3.63Å; Y60-V156 HydrophobicContact CG-CG1 4.15Å; Y60-I158 HydrophobicContact CD1-CD1 4.14Å; Y60-I158 HydrophobicContact CD1-CG1 3.65Å; Y60-I158 HydrophobicContact CE1-CD1 3.74Å; Y60-I158 HydrophobicContact CE1-CG1 3.74Å; Y60-Y260 PolarHBondContact OH-OH 3.35Å
61	N	95.4	Very high	96.3	Very high	52 Å²	52	40.4 Å²	40.4	28%	0.278	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	93.6	171.8	-177.6	15.1	0	0	0	111.3	E63 V156 D157	N61-E63 PolarHBondContact O-N 2.98Å; N61-E63 PolarHBondContact OD1-N 2.71Å; N61-E63 VanDerWaalsContact OD1-N 3.08Å; N61-V156 WeakPolarHBondContact O-CA 3.21Å; N61-D157 HydrophobicContact CB-CB 4.16Å; N61-D157 PolarHBondContact N-O 2.85Å
62	F	97	Very high	96.3	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.026	22%	0.22	C	C	.	.			trans	-76.2	0.4	175.6	-64.3	-77.2	0	0	0	114.4	L56 P57 Y60 I64 L87 F90 I94 Y135 V154 V156	L56-F62 HydrophobicContact CB-CD2 4.13Å; L56-F62 HydrophobicContact CB-CE2 4.13Å; L56-F62 HydrophobicContact CD1-CD2 3.94Å; L56-F62 HydrophobicContact CD1-CG 4.47Å; L56-F62 HydrophobicContact CD2-CE2 4.36Å; L56-F62 HydrophobicContact CG-CD2 4.44Å; P57-F62 HydrophobicContact CG-CE2 4.08Å; Y60-F62 HydrophobicContact CG-CE2 4.41Å; Y60-F62 HydrophobicContact CG-CZ 4.32Å; F62-I64 HydrophobicContact CB-CD1 3.71Å; F62-I64 HydrophobicContact CB-CG1 3.92Å; F62-I64 PolarHBondContact O-N 3.45Å; F62-L87 HydrophobicContact CE1-CD1 4.47Å; F62-L87 HydrophobicContact CE1-CD2 4.24Å; F62-L87 HydrophobicContact CZ-CD2 4.37Å; F62-F90 HydrophobicContact CE1-CD2 4.2Å; F62-F90 HydrophobicContact CZ-CB 4.2Å; F62-F90 AromaticContact CZ-CD2 3.58Å; F62-F90 HydrophobicContact CZ-CD2 3.58Å; F62-F90 HydrophobicContact CZ-CE2 4.15Å; F62-F90 AromaticContact CZ-CG 3.91Å; F62-F90 HydrophobicContact CZ-CG 3.91Å; F62-I94 HydrophobicContact CB-CD1 4.49Å; F62-I94 HydrophobicContact CD1-CD1 3.65Å; F62-I94 HydrophobicContact CE1-CD1 3.96Å; F62-I94 HydrophobicContact CG-CD1 4.02Å; F62-Y135 HydrophobicContact CB-CE1 4.21Å; F62-Y135 AromaticContact CD1-CD1 4Å; F62-Y135 HydrophobicContact CD1-CD1 4Å; F62-Y135 HydrophobicContact CD1-CE1 4.05Å; F62-V154 WeakPolarHBondContact O-CG1 3.45Å; F62-V156 HydrophobicContact CD1-CG1 4.34Å; F62-V156 HydrophobicContact CD1-CG2 4.22Å; F62-V156 HydrophobicContact CE1-CG1 4.19Å; F62-V156 HydrophobicContact CE1-CG2 4.47Å
63	E	96.3	Very high	96.2	Very high	39 Å²	39	47.2 Å²	47.2	18%	0.182	24%	0.24	C	C	.	.			trans	51.4	31.8	179.7	-58.8	-166.9	167.6	0	0	114.8	N61 F65 K66 T67 V154	N61-E63 PolarHBondContact O-N 2.98Å; N61-E63 PolarHBondContact OD1-N 2.71Å; N61-E63 VanDerWaalsContact OD1-N 3.08Å; E63-F65 VanDerWaalsContact C-N 3.33Å; E63-F65 PolarHBondContact O-N 2.87Å; E63-K66 HydrophobicContact CB-CB 4.21Å; E63-K66 HydrophobicContact CB-CD 4.28Å; E63-K66 WeakPolarHBondContact O-CA 3.25Å; E63-K66 VanDerWaalsContact O-CB 3.3Å; E63-K66 WeakPolarHBondContact O-CB 3.46Å; E63-K66 PolarHBondContact O-N 3.2Å; E63-K66 WeakPolarHBondContact OE2-CD 3.41Å; E63-K66 WeakPolarHBondContact OE2-CE 3.26Å; E63-K66 IonicContact OE2-NZ 2.74Å; E63-K66 PolarHBondContact OE2-NZ 3.36Å; E63-T67 PolarHBondContact O-N 3.44Å; E63-T67 PolarHBondContact O-OG1 3.05Å; E63-V154 HydrophobicContact CB-CG1 4.06Å; E63-V154 HydrophobicContact CB-CG2 4.41Å; E63-V154 HydrophobicContact CG-CG1 4.09Å
64	I	97.7	Very high	96	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-52	-46.2	-173.8	-58.6	-58.2	0	0	0	113	L49 I53 L56 F62 K66 T67 I68 I94 I97	L49-I64 HydrophobicContact CD1-CG2 4.33Å; I53-I64 HydrophobicContact CD1-CB 3.81Å; I53-I64 HydrophobicContact CD1-CG1 4.5Å; I53-I64 HydrophobicContact CD1-CG2 3.76Å; I53-I64 HydrophobicContact CG1-CB 4.06Å; I53-I64 HydrophobicContact CG1-CG1 4.27Å; I53-I64 HydrophobicContact CG1-CG2 3.88Å; L56-I64 HydrophobicContact CD1-CD1 4.17Å; L56-I64 HydrophobicContact CD1-CG1 4Å; F62-I64 HydrophobicContact CB-CD1 3.71Å; F62-I64 HydrophobicContact CB-CG1 3.92Å; F62-I64 PolarHBondContact O-N 3.45Å; I64-K66 VanDerWaalsContact C-N 3.27Å; I64-K66 PolarHBondContact O-N 2.79Å; I64-T67 PolarHBondContact O-N 3.28Å; I64-T67 VanDerWaalsContact O-N 3.12Å; I64-I68 HydrophobicContact CG2-CD1 3.76Å; I64-I68 HydrophobicContact CG2-CG1 4.33Å; I64-I68 WeakPolarHBondContact O-CG1 3.39Å; I64-I68 PolarHBondContact O-N 2.83Å; I64-I94 HydrophobicContact CD1-CG1 4.13Å; I64-I94 HydrophobicContact CD1-CG2 4.06Å; I64-I97 HydrophobicContact CG2-CG2 3.67Å
65	F	97.3	Very high	96	Very high	52 Å²	52	50 Å²	50	23%	0.228	24%	0.242	C	C	.	.	H	α-helix	trans	-56.7	-39.9	177.2	-62.3	-71.2	0	0	0	112.8	I39 I43 L44 L49 K50 I53 E63 W69	I39-F65 HydrophobicContact CD1-CB 4.19Å; I43-F65 HydrophobicContact CG2-CB 4.25Å; I43-F65 HydrophobicContact CG2-CD1 3.89Å; I43-F65 WeakPolarHBondContact O-CD1 3.32Å; I43-F65 VanDerWaalsContact O-CE1 3.31Å; I43-F65 WeakPolarHBondContact O-CE1 3.34Å; L44-F65 HydrophobicContact CD2-CB 4.1Å; L44-F65 HydrophobicContact CD2-CD1 4.39Å; L44-F65 HydrophobicContact CD2-CD2 4.43Å; L44-F65 HydrophobicContact CD2-CG 4.08Å; L49-F65 HydrophobicContact CD2-CD1 3.55Å; L49-F65 HydrophobicContact CD2-CE1 3.58Å; L49-F65 HydrophobicContact CG-CD1 4.2Å; L49-F65 HydrophobicContact CG-CE1 3.79Å; K50-F65 HydrophobicContact CG-CZ 4.12Å; I53-F65 HydrophobicContact CD1-CD1 4.2Å; I53-F65 HydrophobicContact CD1-CD2 4.16Å; I53-F65 HydrophobicContact CD1-CE1 3.76Å; I53-F65 HydrophobicContact CD1-CE2 3.7Å; I53-F65 HydrophobicContact CD1-CG 4.39Å; I53-F65 HydrophobicContact CD1-CZ 3.49Å; I53-F65 VanDerWaalsContact CD1-CZ 3.49Å; E63-F65 VanDerWaalsContact C-N 3.33Å; E63-F65 PolarHBondContact O-N 2.87Å; F65-W69 WeakPolarHBondContact O-CB 3.24Å; F65-W69 PolarHBondContact O-N 3.2Å
66	K	96.3	Very high	96.1	Very high	39 Å²	39	44.9 Å²	44.9	17%	0.17	21%	0.214	C	C	.	.	H	α-helix	trans	-69.4	-40.6	178.3	-178.9	-167.3	175.5	-174.9	0	110.6	I35 I39 E63 I64 W69 K70 L152	I35-K66 HydrophobicContact CG2-CD 3.91Å; I35-K66 HydrophobicContact CG2-CG 3.92Å; I39-K66 HydrophobicContact CD1-CB 4.01Å; E63-K66 HydrophobicContact CB-CB 4.21Å; E63-K66 HydrophobicContact CB-CD 4.28Å; E63-K66 WeakPolarHBondContact O-CA 3.25Å; E63-K66 VanDerWaalsContact O-CB 3.3Å; E63-K66 WeakPolarHBondContact O-CB 3.46Å; E63-K66 PolarHBondContact O-N 3.2Å; E63-K66 WeakPolarHBondContact OE2-CD 3.41Å; E63-K66 WeakPolarHBondContact OE2-CE 3.26Å; E63-K66 IonicContact OE2-NZ 2.74Å; E63-K66 PolarHBondContact OE2-NZ 3.36Å; I64-K66 VanDerWaalsContact C-N 3.27Å; I64-K66 PolarHBondContact O-N 2.79Å; K66-W69 PolarHBondContact O-N 2.75Å; K66-K70 WeakPolarHBondContact O-CB 3.4Å; K66-K70 PolarHBondContact O-N 3.37Å; K66-L152 HydrophobicContact CD-CD1 4.48Å
67	T	97.6	Very high	96.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-48	176.4	-55.6	0	0	0	0	111.1	E63 I64 W69 K70 I71 L98 V133 L152	E63-T67 PolarHBondContact O-N 3.44Å; E63-T67 PolarHBondContact O-OG1 3.05Å; I64-T67 PolarHBondContact O-N 3.28Å; I64-T67 VanDerWaalsContact O-N 3.12Å; T67-W69 PolarHBondContact O-N 3.02Å; T67-K70 WeakPolarHBondContact O-CB 3.5Å; T67-K70 PolarHBondContact O-N 2.82Å; T67-I71 HydrophobicContact CG2-CD1 3.94Å; T67-I71 VanDerWaalsContact O-CG1 3.32Å; T67-I71 WeakPolarHBondContact O-CG1 3.38Å; T67-I71 PolarHBondContact O-N 3.3Å; T67-L98 HydrophobicContact CG2-CD1 3.94Å; T67-L98 HydrophobicContact CG2-CD2 3.66Å; T67-L98 HydrophobicContact CG2-CG 4.48Å; T67-V133 HydrophobicContact CG2-CG1 4.44Å; T67-V133 HydrophobicContact CG2-CG2 3.81Å; T67-L152 HydrophobicContact CG2-CD2 4.17Å; T67-L152 WeakPolarHBondContact OG1-CD2 3.47Å
68	I	98	Very high	96.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-47.6	175.8	-68.9	168.6	0	0	0	110.9	I43 L49 I64 K70 I71 R72 I97 L98 F101 A102	I43-I68 HydrophobicContact CD1-CG2 4.35Å; I43-I68 HydrophobicContact CG2-CG2 4.39Å; L49-I68 HydrophobicContact CD1-CD1 3.44Å; L49-I68 VanDerWaalsContact CD1-CD1 3.44Å; L49-I68 HydrophobicContact CD2-CD1 3.56Å; L49-I68 HydrophobicContact CG-CD1 4.16Å; I64-I68 HydrophobicContact CG2-CD1 3.76Å; I64-I68 HydrophobicContact CG2-CG1 4.33Å; I64-I68 WeakPolarHBondContact O-CG1 3.39Å; I64-I68 PolarHBondContact O-N 2.83Å; I68-K70 VanDerWaalsContact C-N 3.31Å; I68-K70 PolarHBondContact O-N 3.34Å; I68-I71 PolarHBondContact O-N 2.84Å; I68-R72 HydrophobicContact CG2-CG 4.29Å; I68-R72 WeakPolarHBondContact O-CB 3.31Å; I68-R72 WeakPolarHBondContact O-CG 3.48Å; I68-R72 PolarHBondContact O-N 3.19Å; I68-I97 HydrophobicContact CD1-CG2 4.28Å; I68-L98 HydrophobicContact CG1-CD2 3.73Å; I68-F101 HydrophobicContact CD1-CB 3.74Å; I68-F101 HydrophobicContact CG1-CB 4.48Å; I68-A102 HydrophobicContact CG1-CB 4.38Å; I68-A102 HydrophobicContact CG2-CB 4.21Å
69	W	97	Very high	96.6	Very high	42 Å²	42	43.5 Å²	43.5	16%	0.159	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-43.4	178.3	174.2	55	0	0	0	112	R38 I39 I43 F65 K66 T67 I71 R72 Q73	R38-W69 HydrophobicContact CB-CH2 3.5Å; R38-W69 HydrophobicContact CB-CZ2 3.87Å; R38-W69 HydrophobicContact CB-CZ3 4.12Å; R38-W69 HydrophobicContact CG-CH2 4.48Å; R38-W69 WeakPolarHBondContact O-CZ2 3.49Å; I39-W69 HydrophobicContact CG1-CB 4.34Å; I39-W69 HydrophobicContact CG1-CD2 4.2Å; I39-W69 HydrophobicContact CG1-CE3 3.97Å; I39-W69 HydrophobicContact CG1-CG 4.37Å; I39-W69 HydrophobicContact CG2-CB 4.19Å; I39-W69 HydrophobicContact CG2-CG 4.5Å; I43-W69 HydrophobicContact CD1-CB 3.92Å; I43-W69 HydrophobicContact CD1-CG 4.47Å; F65-W69 WeakPolarHBondContact O-CB 3.24Å; F65-W69 PolarHBondContact O-N 3.2Å; K66-W69 PolarHBondContact O-N 2.75Å; T67-W69 PolarHBondContact O-N 3.02Å; W69-I71 PolarHBondContact O-N 3.48Å; W69-R72 PolarHBondContact O-N 3.41Å; W69-Q73 WeakPolarHBondContact O-CB 3.43Å; W69-Q73 PolarHBondContact O-N 3.38Å
70	K	96.1	Very high	96.8	Very high	51 Å²	51	41.7 Å²	41.7	22%	0.222	19%	0.19	C	C	.	.	H	α-helix	trans	-60	-46.3	177.2	-178.1	64.9	171.9	173.2	0	111.9	K66 T67 I68 Q74 L131	K66-K70 WeakPolarHBondContact O-CB 3.4Å; K66-K70 PolarHBondContact O-N 3.37Å; T67-K70 WeakPolarHBondContact O-CB 3.5Å; T67-K70 PolarHBondContact O-N 2.82Å; I68-K70 VanDerWaalsContact C-N 3.31Å; I68-K70 PolarHBondContact O-N 3.34Å; K70-Q74 VanDerWaalsContact NZ-CD 3.34Å; K70-Q74 PolarHBondContact O-N 3.1Å; K70-L131 HydrophobicContact CG-CD2 4.44Å
71	I	97.7	Very high	96.9	Very high	1 Å²	1	39 Å²	39	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-61.7	-51.2	178.3	-67	161.5	0	0	0	110.5	T67 I68 W69 Q74 N75 I76 V79 L98 A102 C104 L131	T67-I71 HydrophobicContact CG2-CD1 3.94Å; T67-I71 VanDerWaalsContact O-CG1 3.32Å; T67-I71 WeakPolarHBondContact O-CG1 3.38Å; T67-I71 PolarHBondContact O-N 3.3Å; I68-I71 PolarHBondContact O-N 2.84Å; W69-I71 PolarHBondContact O-N 3.48Å; I71-Q74 PolarHBondContact O-N 3.01Å; I71-N75 PolarHBondContact O-N 3.27Å; I71-I76 HydrophobicContact CG2-CB 4.11Å; I71-I76 PolarHBondContact O-N 3.04Å; I71-I76 VanDerWaalsContact O-N 3.07Å; I71-V79 HydrophobicContact CD1-CG2 3.88Å; I71-V79 HydrophobicContact CG1-CG2 3.99Å; I71-L98 HydrophobicContact CD1-CD1 4.47Å; I71-L98 HydrophobicContact CD1-CD2 4.07Å; I71-A102 HydrophobicContact CB-CB 3.89Å; I71-A102 HydrophobicContact CD1-CB 3.99Å; I71-A102 HydrophobicContact CG2-CB 3.56Å; I71-C104 HydrophobicContact CG2-CB 3.94Å; I71-L131 HydrophobicContact CD1-CD2 4.33Å; I71-L131 HydrophobicContact CG1-CD2 3.64Å
72	R	96.4	Very high	97	Very high	105 Å²	105	36.8 Å²	36.8	40%	0.396	17%	0.167	S	C	.	.	H	α-helix	trans	-62.3	-47	-179.7	-71.6	-177.5	177.9	-171.9	2.3	112.1	I68 W69 Q74 N75 F101	I68-R72 HydrophobicContact CG2-CG 4.29Å; I68-R72 WeakPolarHBondContact O-CB 3.31Å; I68-R72 WeakPolarHBondContact O-CG 3.48Å; I68-R72 PolarHBondContact O-N 3.19Å; W69-R72 PolarHBondContact O-N 3.41Å; R72-Q74 PolarHBondContact O-N 3.24Å; R72-N75 PolarHBondContact O-N 3.22Å; R72-F101 PolarHBondContact NE-O 3.03Å; R72-F101 PolarHBondContact NH2-O 3.34Å
73	Q	95	Very high	97	Very high	116 Å²	116	36.7 Å²	36.7	54%	0.542	17%	0.167	S	C	.	.	H	α-helix	trans	-59.1	-32.5	-178	-174.9	-176.4	35.2	0	0	112.4	W69	W69-Q73 WeakPolarHBondContact O-CB 3.43Å; W69-Q73 PolarHBondContact O-N 3.38Å
74	Q	94.4	Very high	97	Very high	68 Å²	68	35.8 Å²	35.8	32%	0.318	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108	5.7	-175.1	-59.7	-175.6	-39.1	0	0	113.2	K70 I71 R72 I76 Q150	K70-Q74 VanDerWaalsContact NZ-CD 3.34Å; K70-Q74 PolarHBondContact O-N 3.1Å; I71-Q74 PolarHBondContact O-N 3.01Å; R72-Q74 PolarHBondContact O-N 3.24Å; Q74-I76 HydrophobicContact CB-CD1 3.87Å; Q74-I76 HydrophobicContact CB-CG1 3.97Å; Q74-I76 PolarHBondContact O-N 2.97Å; Q74-Q150 VanDerWaalsContact CD-NE2 3.27Å; Q74-Q150 VanDerWaalsContact NE2-NE2 3.12Å
75	N	96.1	Very high	96.7	Very high	108 Å²	108	43.2 Å²	43.2	58%	0.578	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	41.7	-177.4	-166.5	27.5	0	0	0	112.8	I71 R72 K77	I71-N75 PolarHBondContact O-N 3.27Å; R72-N75 PolarHBondContact O-N 3.22Å; N75-K77 VanDerWaalsContact OD1-CE 3.27Å; N75-K77 WeakPolarHBondContact OD1-CE 3.39Å; N75-K77 PolarHBondContact OD1-NZ 2.79Å
76	I	97.4	Very high	96.5	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.036	22%	0.217	C	C	.	.			trans	-68.9	134.9	178.6	-71.9	154.9	0	0	0	109.2	I71 Q74 V79 Q130 L131	I71-I76 HydrophobicContact CG2-CB 4.11Å; I71-I76 PolarHBondContact O-N 3.04Å; I71-I76 VanDerWaalsContact O-N 3.07Å; Q74-I76 HydrophobicContact CB-CD1 3.87Å; Q74-I76 HydrophobicContact CB-CG1 3.97Å; Q74-I76 PolarHBondContact O-N 2.97Å; I76-V79 HydrophobicContact CG2-CG2 3.62Å; I76-Q130 HydrophobicContact CG1-CB 4.33Å; I76-Q130 HydrophobicContact CG2-CB 4.13Å; I76-L131 HydrophobicContact CD1-CB 3.81Å; I76-L131 HydrophobicContact CD1-CD2 4.05Å; I76-L131 HydrophobicContact CD1-CG 4.34Å; I76-L131 HydrophobicContact CG1-CB 4.47Å; I76-L131 HydrophobicContact CG2-CB 3.92Å
77	K	97.6	Very high	96.5	Very high	86 Å²	86	42.3 Å²	42.3	37%	0.374	21%	0.212	S	C	.	.			trans	-106	-36.4	-178.9	-61.9	-55.2	179.8	-166.4	0	113.5	N75 C104 N105	N75-K77 VanDerWaalsContact OD1-CE 3.27Å; N75-K77 WeakPolarHBondContact OD1-CE 3.39Å; N75-K77 PolarHBondContact OD1-NZ 2.79Å; K77-C104 CarbonylContact O-C 3.25Å; K77-C104 WeakPolarHBondContact O-CA 3.41Å; K77-C104 WeakPolarHBondContact O-CB 3.5Å; K77-N105 PolarHBondContact O-N 3.17Å
78	N	98	Very high	96.4	Very high	41 Å²	41	44.8 Å²	44.8	22%	0.219	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.4	-179.5	-61.7	-31.7	0	0	0	110.1	N105 D128 Q130 L131	N78-N105 WeakPolarHBondContact CA-O 3.18Å; N78-N105 PolarHBondContact OD1-ND2 3.25Å; N78-D128 WeakPolarHBondContact CB-O 3.31Å; N78-D128 PolarHBondContact ND2-O 2.92Å; N78-Q130 VanDerWaalsContact N-OE1 3.09Å; N78-Q130 PolarHBondContact O-N 3.48Å; N78-L131 PolarHBondContact O-N 2.67Å
79	V	98.2	Very high	96.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.9	-175.7	-175.6	0	0	0	0	110.3	I71 I76 L81 C104 N105 T106 V107 L131 V133	I71-V79 HydrophobicContact CD1-CG2 3.88Å; I71-V79 HydrophobicContact CG1-CG2 3.99Å; I76-V79 HydrophobicContact CG2-CG2 3.62Å; V79-L81 HydrophobicContact CG1-CD2 3.8Å; V79-C104 HydrophobicContact CG2-CB 4.02Å; V79-N105 PolarHBondContact N-O 3.29Å; V79-T106 HydrophobicContact CB-CG2 4.42Å; V79-T106 CarbonylContact O-C 3.42Å; V79-T106 VanDerWaalsContact O-CA 3.24Å; V79-T106 WeakPolarHBondContact O-CA 3.41Å; V79-V107 PolarHBondContact O-N 2.95Å; V79-L131 CarbonylContact C-O 3.58Å; V79-L131 WeakPolarHBondContact CA-O 3.3Å; V79-L131 HydrophobicContact CG1-CB 4.35Å; V79-L131 HydrophobicContact CG1-CD2 4.09Å; V79-L131 HydrophobicContact CG1-CG 4.28Å; V79-L131 HydrophobicContact CG2-CB 4.39Å; V79-L131 HydrophobicContact CG2-CD2 4.4Å; V79-V133 HydrophobicContact CG1-CG2 3.8Å
80	A	97.8	Very high	96.3	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	135.8	169.9	0	0	0	0	0	110.3	V107 M109 V124 C129 L131 L132 V133	A80-V107 CarbonylContact C-O 3.51Å; A80-V107 WeakPolarHBondContact CA-O 3.39Å; A80-M109 HydrophobicContact CB-CG 4.47Å; A80-M109 HydrophobicContact CB-SD 3.96Å; A80-V124 HydrophobicContact CB-CG2 3.79Å; A80-C129 HydrophobicContact CB-CB 3.97Å; A80-L131 PolarHBondContact N-O 2.8Å; A80-L132 HydrophobicContact CB-CD1 3.95Å; A80-L132 CarbonylContact O-C 3.58Å; A80-L132 WeakPolarHBondContact O-CA 3.47Å; A80-V133 PolarHBondContact O-N 2.93Å
81	L	98	Very high	96.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.3	178.2	-53.6	178.2	0	0	0	109.3	V79 F83 I94 A95 L98 T106 V107 I108 M109 V133 Y135	V79-L81 HydrophobicContact CG1-CD2 3.8Å; L81-F83 HydrophobicContact CB-CD2 4.41Å; L81-F83 HydrophobicContact CB-CE2 3.46Å; L81-F83 VanDerWaalsContact CB-CE2 3.46Å; L81-F83 HydrophobicContact CB-CZ 3.9Å; L81-F83 HydrophobicContact CD1-CE2 4.45Å; L81-F83 HydrophobicContact CD1-CZ 4.39Å; L81-I94 HydrophobicContact CD1-CG2 4.3Å; L81-A95 HydrophobicContact CD1-CB 4.01Å; L81-L98 HydrophobicContact CD1-CD1 4.3Å; L81-L98 HydrophobicContact CD2-CD1 3.7Å; L81-T106 HydrophobicContact CD1-CG2 4.19Å; L81-V107 PolarHBondContact N-O 2.67Å; L81-I108 HydrophobicContact CD1-CG1 4.47Å; L81-M109 WeakPolarHBondContact O-CB 3.33Å; L81-M109 PolarHBondContact O-N 3.23Å; L81-V133 HydrophobicContact CD2-CB 3.88Å; L81-V133 HydrophobicContact CD2-CG2 3.96Å; L81-Y135 HydrophobicContact CD2-CE2 4.34Å
82	Q	97.2	Very high	96.4	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.2	179	-166.4	179.7	33.3	0	0	110.4	M109 A113 C118 L132 V133 H134 Y135	Q82-M109 HydrophobicContact CB-CB 4.3Å; Q82-M109 HydrophobicContact CB-SD 3.92Å; Q82-M109 HydrophobicContact CG-CB 4.3Å; Q82-M109 HydrophobicContact CG-SD 4.32Å; Q82-A113 HydrophobicContact CG-CB 4.16Å; Q82-C118 PolarHBondContact NE2-O 2.73Å; Q82-L132 HydrophobicContact CB-CD1 3.87Å; Q82-V133 PolarHBondContact N-O 3.06Å; Q82-H134 PolarHBondContact OE1-CE1 2.86Å; Q82-H134 VanDerWaalsContact OE1-CE1 3.3Å; Q82-H134 PolarHBondContact OE1-ND1 2.78Å; Q82-Y135 PolarHBondContact O-N 3.43Å
83	F	97	Very high	96.4	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.018	27%	0.269	C	S	.	.			trans	-126.1	145.8	-175.3	-58.6	-90.6	0	0	0	110.9	L81 L87 L88 S91 I94 Y135	L81-F83 HydrophobicContact CB-CD2 4.41Å; L81-F83 HydrophobicContact CB-CE2 3.46Å; L81-F83 VanDerWaalsContact CB-CE2 3.46Å; L81-F83 HydrophobicContact CB-CZ 3.9Å; L81-F83 HydrophobicContact CD1-CE2 4.45Å; L81-F83 HydrophobicContact CD1-CZ 4.39Å; F83-L87 HydrophobicContact CB-CB 4.35Å; F83-L87 HydrophobicContact CD1-CB 4.12Å; F83-L88 HydrophobicContact CB-CD1 4.3Å; F83-L88 HydrophobicContact CD2-CD1 4.24Å; F83-S91 VanDerWaalsContact CE2-CB 3.4Å; F83-I94 HydrophobicContact CE1-CD1 3.79Å; F83-I94 HydrophobicContact CZ-CD1 4.2Å; F83-I94 HydrophobicContact CZ-CG2 4.43Å; F83-Y135 AromaticContact CD1-CD2 3.59Å; F83-Y135 HydrophobicContact CD1-CD2 3.59Å; F83-Y135 HydrophobicContact CD1-CE2 4.35Å; F83-Y135 AromaticContact CD1-CG 3.82Å; F83-Y135 HydrophobicContact CD1-CG 3.82Å; F83-Y135 HydrophobicContact CE1-CD1 4.36Å; F83-Y135 AromaticContact CE1-CD2 3.2Å; F83-Y135 HydrophobicContact CE1-CD2 3.2Å; F83-Y135 AromaticContact CE1-CE2 3.51Å; F83-Y135 HydrophobicContact CE1-CE2 3.51Å; F83-Y135 AromaticContact CE1-CG 3.68Å; F83-Y135 HydrophobicContact CE1-CG 3.68Å; F83-Y135 HydrophobicContact CE2-CD2 4.47Å; F83-Y135 HydrophobicContact CG-CD2 4.37Å; F83-Y135 AromaticContact CZ-CD2 3.71Å; F83-Y135 HydrophobicContact CZ-CD2 3.71Å; F83-Y135 AromaticContact CZ-CE2 3.67Å; F83-Y135 HydrophobicContact CZ-CE2 3.67Å
84	P	95.3	Very high	96.6	Very high	21 Å²	21	44.8 Å²	44.8	14%	0.136	24%	0.243	C	C	.	.			trans	-65.6	157.2	157.2	30.3	-34.6	0	0	0	109.6	G86 L87 L88 A113 Y135	P84-G86 VanDerWaalsContact C-N 3.28Å; P84-G86 PolarHBondContact O-N 2.93Å; P84-G86 VanDerWaalsContact O-N 3.15Å; P84-L87 HydrophobicContact CG-CB 4.13Å; P84-L87 HydrophobicContact CG-CD1 3.82Å; P84-L87 HydrophobicContact CG-CG 3.94Å; P84-L87 PolarHBondContact O-N 3.27Å; P84-L88 PolarHBondContact O-N 3.3Å; P84-A113 WeakPolarHBondContact CA-O 3.21Å; P84-Y135 VanDerWaalsContact CD-O 3.24Å; P84-Y135 WeakPolarHBondContact CD-O 3.36Å
85	E	92.8	Very high	96.8	Very high	161 Å²	161	41.7 Å²	41.7	75%	0.752	23%	0.23	S	C	*	.	H	α-helix	trans	-48.1	-47.2	-176.6	-173.5	-179.5	178.6	0	0	113	L87 L88	E85-L87 PolarHBondContact O-N 3.01Å; E85-L87 VanDerWaalsContact O-N 3.12Å; E85-L88 WeakPolarHBondContact O-CB 3.48Å; E85-L88 PolarHBondContact O-N 3.09Å; E85-L88 VanDerWaalsContact O-N 3.16Å
86	G	92.8	Very high	96.9	Very high	58 Å²	58	41.4 Å²	41.4	60%	0.598	23%	0.228	S	C	*	.	H	α-helix	trans	-66.7	-12	-178.4	0	0	0	0	0	115.7	P84	P84-G86 VanDerWaalsContact C-N 3.28Å; P84-G86 PolarHBondContact O-N 2.93Å; P84-G86 VanDerWaalsContact O-N 3.15Å
87	L	95.7	Very high	97	Very high	14 Å²	14	41.3 Å²	41.3	7%	0.073	23%	0.228	C	C	.	.	H	α-helix	trans	-109.7	-7.7	176.4	-61.7	-177.9	0	0	0	113.1	Y60 F62 F83 P84 E85 M89 F90 V156	Y60-L87 HydrophobicContact CD1-CD2 4.28Å; Y60-L87 HydrophobicContact CE1-CD2 4.21Å; F62-L87 HydrophobicContact CE1-CD1 4.47Å; F62-L87 HydrophobicContact CE1-CD2 4.24Å; F62-L87 HydrophobicContact CZ-CD2 4.37Å; F83-L87 HydrophobicContact CB-CB 4.35Å; F83-L87 HydrophobicContact CD1-CB 4.12Å; P84-L87 HydrophobicContact CG-CB 4.13Å; P84-L87 HydrophobicContact CG-CD1 3.82Å; P84-L87 HydrophobicContact CG-CG 3.94Å; P84-L87 PolarHBondContact O-N 3.27Å; E85-L87 PolarHBondContact O-N 3.01Å; E85-L87 VanDerWaalsContact O-N 3.12Å; L87-M89 PolarHBondContact O-N 3.48Å; L87-F90 HydrophobicContact CB-CD2 4.46Å; L87-F90 HydrophobicContact CD2-CD2 4.1Å; L87-F90 HydrophobicContact CD2-CE2 4.06Å; L87-F90 PolarHBondContact O-N 2.91Å; L87-V156 HydrophobicContact CD1-CB 4.2Å; L87-V156 HydrophobicContact CD1-CG1 4.21Å; L87-V156 HydrophobicContact CD1-CG2 3.77Å
88	L	95.6	Very high	97	Very high	53 Å²	53	37.2 Å²	37.2	28%	0.277	21%	0.21	S	C	.	.	H	α-helix	trans	-60.2	-30.8	-177.4	-170.4	64.4	0	0	0	111.8	F83 P84 E85 F90 S91 I108 T110	F83-L88 HydrophobicContact CB-CD1 4.3Å; F83-L88 HydrophobicContact CD2-CD1 4.24Å; P84-L88 PolarHBondContact O-N 3.3Å; E85-L88 WeakPolarHBondContact O-CB 3.48Å; E85-L88 PolarHBondContact O-N 3.09Å; E85-L88 VanDerWaalsContact O-N 3.16Å; L88-F90 PolarHBondContact O-N 3.35Å; L88-S91 VanDerWaalsContact O-CB 3.24Å; L88-S91 WeakPolarHBondContact O-CB 3.48Å; L88-S91 PolarHBondContact O-N 3.05Å; L88-S91 PolarHBondContact O-OG 3.25Å; L88-I108 HydrophobicContact CD1-CG2 4.2Å; L88-T110 HydrophobicContact CD1-CG2 4.43Å
89	M	95.8	Very high	97	Very high	146 Å²	146	38.9 Å²	38.9	72%	0.719	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.3	175.5	65.4	-173.7	-70.4	0	0	114.6	L87	L87-M89 PolarHBondContact O-N 3.48Å
90	F	97.2	Very high	97	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.105	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-3.1	178.2	-52.8	-63	0	0	0	113.2	L56 P57 F62 L87 L88 C92 I93 I94	L56-F90 HydrophobicContact CD2-CB 4.05Å; L56-F90 HydrophobicContact CD2-CD1 4.28Å; L56-F90 HydrophobicContact CD2-CG 4.45Å; P57-F90 VanDerWaalsContact CD-CE1 3.48Å; P57-F90 HydrophobicContact CG-CD1 4.29Å; P57-F90 HydrophobicContact CG-CE1 3.63Å; P57-F90 HydrophobicContact CG-CE2 4.25Å; P57-F90 HydrophobicContact CG-CZ 3.61Å; F62-F90 HydrophobicContact CE1-CD2 4.2Å; F62-F90 HydrophobicContact CZ-CB 4.2Å; F62-F90 AromaticContact CZ-CD2 3.58Å; F62-F90 HydrophobicContact CZ-CD2 3.58Å; F62-F90 HydrophobicContact CZ-CE2 4.15Å; F62-F90 AromaticContact CZ-CG 3.91Å; F62-F90 HydrophobicContact CZ-CG 3.91Å; L87-F90 HydrophobicContact CB-CD2 4.46Å; L87-F90 HydrophobicContact CD2-CD2 4.1Å; L87-F90 HydrophobicContact CD2-CE2 4.06Å; L87-F90 PolarHBondContact O-N 2.91Å; L88-F90 PolarHBondContact O-N 3.35Å; F90-C92 PolarHBondContact O-N 3.33Å; F90-I93 PolarHBondContact O-N 2.6Å; F90-I94 HydrophobicContact CB-CD1 4.04Å; F90-I94 WeakPolarHBondContact O-CG1 3.42Å; F90-I94 PolarHBondContact O-N 2.63Å
91	S	97.7	Very high	97	Very high	8 Å²	8	46 Å²	46	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-62.1	-43.7	-168.8	64.9	0	0	0	0	113.2	F83 L88 I94 A95	F83-S91 VanDerWaalsContact CE2-CB 3.4Å; L88-S91 VanDerWaalsContact O-CB 3.24Å; L88-S91 WeakPolarHBondContact O-CB 3.48Å; L88-S91 PolarHBondContact O-N 3.05Å; L88-S91 PolarHBondContact O-OG 3.25Å; S91-I94 PolarHBondContact O-N 2.95Å; S91-A95 VanDerWaalsContact O-CB 3.31Å; S91-A95 WeakPolarHBondContact O-CB 3.26Å; S91-A95 PolarHBondContact O-N 3.03Å
92	C	98	Very high	97	Very high	75 Å²	75	46.4 Å²	46.4	51%	0.507	25%	0.253	S	S	.	.	H	α-helix	trans	-66.9	-44.2	-178.6	-59.1	0	0	0	0	111.7	F90 I94 A95 D96	F90-C92 PolarHBondContact O-N 3.33Å; C92-I94 VanDerWaalsContact C-N 3.3Å; C92-I94 PolarHBondContact O-N 2.95Å; C92-A95 WeakPolarHBondContact O-CB 3.24Å; C92-A95 PolarHBondContact O-N 2.92Å; C92-D96 VanDerWaalsContact O-CG 3.23Å; C92-D96 PolarHBondContact O-N 2.84Å
93	I	97.9	Very high	96.9	Very high	61 Å²	61	52.1 Å²	52.1	31%	0.313	28%	0.283	S	S	.	.	H	α-helix	trans	-61.8	-42.4	177.3	-60.7	173.3	0	0	0	110.3	N55 L56 F90 I97	N55-I93 HydrophobicContact CB-CG2 4.36Å; L56-I93 HydrophobicContact CD2-CB 4.1Å; L56-I93 HydrophobicContact CD2-CG2 3.76Å; L56-I93 HydrophobicContact CG-CG2 4.11Å; F90-I93 PolarHBondContact O-N 2.6Å; I93-I97 HydrophobicContact CG2-CD1 3.9Å; I93-I97 WeakPolarHBondContact O-CD1 3.42Å; I93-I97 WeakPolarHBondContact O-CG1 3.19Å; I93-I97 PolarHBondContact O-N 2.86Å; I93-I97 VanDerWaalsContact O-N 3.09Å
94	I	98.5	Very high	97	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-43.4	176.9	-68.6	170.9	0	0	0	110.8	L56 F62 I64 L81 F83 F90 S91 C92 I97 L98 Y135	L56-I94 HydrophobicContact CD1-CG1 3.95Å; L56-I94 HydrophobicContact CD2-CD1 4.46Å; L56-I94 HydrophobicContact CD2-CG1 3.96Å; F62-I94 HydrophobicContact CB-CD1 4.49Å; F62-I94 HydrophobicContact CD1-CD1 3.65Å; F62-I94 HydrophobicContact CE1-CD1 3.96Å; F62-I94 HydrophobicContact CG-CD1 4.02Å; I64-I94 HydrophobicContact CD1-CG1 4.13Å; I64-I94 HydrophobicContact CD1-CG2 4.06Å; L81-I94 HydrophobicContact CD1-CG2 4.3Å; F83-I94 HydrophobicContact CE1-CD1 3.79Å; F83-I94 HydrophobicContact CZ-CD1 4.2Å; F83-I94 HydrophobicContact CZ-CG2 4.43Å; F90-I94 HydrophobicContact CB-CD1 4.04Å; F90-I94 WeakPolarHBondContact O-CG1 3.42Å; F90-I94 PolarHBondContact O-N 2.63Å; S91-I94 PolarHBondContact O-N 2.95Å; C92-I94 VanDerWaalsContact C-N 3.3Å; C92-I94 PolarHBondContact O-N 2.95Å; I94-I97 PolarHBondContact O-N 3.29Å; I94-L98 HydrophobicContact CG2-CD1 4.05Å; I94-L98 HydrophobicContact CG2-CG 4.39Å; I94-L98 VanDerWaalsContact O-CG 3.28Å; I94-L98 WeakPolarHBondContact O-CG 3.44Å; I94-L98 PolarHBondContact O-N 3.42Å; I94-Y135 WeakPolarHBondContact CG2-OH 3.31Å
95	A	98.5	Very high	97.1	Very high	4 Å²	4	56 Å²	56	3%	0.033	30%	0.303	C	S	.	.	H	α-helix	trans	-56.3	-55.3	175.3	0	0	0	0	0	111	L81 S91 C92 I97 L98 E99 T106 I108	L81-A95 HydrophobicContact CD1-CB 4.01Å; S91-A95 VanDerWaalsContact O-CB 3.31Å; S91-A95 WeakPolarHBondContact O-CB 3.26Å; S91-A95 PolarHBondContact O-N 3.03Å; C92-A95 WeakPolarHBondContact O-CB 3.24Å; C92-A95 PolarHBondContact O-N 2.92Å; A95-I97 VanDerWaalsContact C-N 3.29Å; A95-I97 PolarHBondContact O-N 3.11Å; A95-L98 PolarHBondContact O-N 3.27Å; A95-E99 WeakPolarHBondContact O-CG 3.5Å; A95-E99 PolarHBondContact O-N 2.9Å; A95-T106 HydrophobicContact CB-CG2 4.44Å; A95-T106 VanDerWaalsContact CB-OG1 3.29Å; A95-T106 WeakPolarHBondContact CB-OG1 3.35Å; A95-I108 HydrophobicContact CB-CD1 4.03Å; A95-I108 HydrophobicContact CB-CG1 4.29Å
96	D	98.4	Very high	97.4	Very high	102 Å²	102	49.4 Å²	49.4	55%	0.545	27%	0.274	S	S	.	.	H	α-helix	trans	-53.3	-45.2	179.1	-66.7	-17.1	0	0	0	111.7	C92 L98 E99 E100	C92-D96 VanDerWaalsContact O-CG 3.23Å; C92-D96 PolarHBondContact O-N 2.84Å; D96-L98 PolarHBondContact O-N 3.36Å; D96-E99 PolarHBondContact O-N 3.1Å; D96-E100 WeakPolarHBondContact O-CB 3.35Å; D96-E100 PolarHBondContact O-N 2.92Å
97	I	98.4	Very high	97.6	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-42.6	177	-66.7	165.5	0	0	0	111.5	L49 A52 I53 L56 I64 I68 I93 I94 A95 F101	L49-I97 HydrophobicContact CD1-CG2 3.63Å; A52-I97 HydrophobicContact CB-CD1 4.28Å; A52-I97 HydrophobicContact CB-CG1 3.92Å; I53-I97 HydrophobicContact CG1-CD1 4.47Å; L56-I97 HydrophobicContact CD1-CD1 4.15Å; I64-I97 HydrophobicContact CG2-CG2 3.67Å; I68-I97 HydrophobicContact CD1-CG2 4.28Å; I93-I97 HydrophobicContact CG2-CD1 3.9Å; I93-I97 WeakPolarHBondContact O-CD1 3.42Å; I93-I97 WeakPolarHBondContact O-CG1 3.19Å; I93-I97 PolarHBondContact O-N 2.86Å; I93-I97 VanDerWaalsContact O-N 3.09Å; I94-I97 PolarHBondContact O-N 3.29Å; A95-I97 VanDerWaalsContact C-N 3.29Å; A95-I97 PolarHBondContact O-N 3.11Å; I97-F101 HydrophobicContact CG2-CD2 3.99Å; I97-F101 WeakPolarHBondContact O-CB 3.49Å; I97-F101 VanDerWaalsContact O-CD2 3.27Å; I97-F101 WeakPolarHBondContact O-CD2 3.39Å; I97-F101 PolarHBondContact O-N 3.14Å
98	L	98.5	Very high	97.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.8	-40.3	-179.8	-66.5	179.2	0	0	0	111.7	T67 I68 I71 L81 I94 A95 D96 A102 T106	T67-L98 HydrophobicContact CG2-CD1 3.94Å; T67-L98 HydrophobicContact CG2-CD2 3.66Å; T67-L98 HydrophobicContact CG2-CG 4.48Å; I68-L98 HydrophobicContact CG1-CD2 3.73Å; I71-L98 HydrophobicContact CD1-CD1 4.47Å; I71-L98 HydrophobicContact CD1-CD2 4.07Å; L81-L98 HydrophobicContact CD1-CD1 4.3Å; L81-L98 HydrophobicContact CD2-CD1 3.7Å; I94-L98 HydrophobicContact CG2-CD1 4.05Å; I94-L98 HydrophobicContact CG2-CG 4.39Å; I94-L98 VanDerWaalsContact O-CG 3.28Å; I94-L98 WeakPolarHBondContact O-CG 3.44Å; I94-L98 PolarHBondContact O-N 3.42Å; A95-L98 PolarHBondContact O-N 3.27Å; D96-L98 PolarHBondContact O-N 3.36Å; L98-A102 WeakPolarHBondContact O-CA 3.35Å; L98-A102 WeakPolarHBondContact O-CB 3.45Å; L98-A102 PolarHBondContact O-N 3.02Å; L98-T106 HydrophobicContact CB-CG2 4.09Å
99	E	98.4	Very high	97.7	Very high	76 Å²	76	49.1 Å²	49.1	36%	0.355	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-46.7	177.9	-61.5	-167.3	167.2	0	0	111.4	A95 D96 N103 C104 T106	A95-E99 WeakPolarHBondContact O-CG 3.5Å; A95-E99 PolarHBondContact O-N 2.9Å; D96-E99 PolarHBondContact O-N 3.1Å; E99-N103 WeakPolarHBondContact O-CA 3.36Å; E99-N103 PolarHBondContact O-N 2.9Å; E99-N103 VanDerWaalsContact O-N 3.14Å; E99-C104 WeakPolarHBondContact CA-O 3.43Å; E99-C104 VanDerWaalsContact CG-O 3.3Å; E99-C104 WeakPolarHBondContact CG-O 3.3Å; E99-T106 HydrophobicContact CG-CG2 3.73Å; E99-T106 WeakPolarHBondContact OE1-CB 3.28Å; E99-T106 PolarHBondContact OE1-N 2.94Å; E99-T106 PolarHBondContact OE1-OG1 2.84Å
100	E	97.8	Very high	97.6	Very high	134 Å²	134	46.9 Å²	46.9	63%	0.626	26%	0.255	S	S	*	.	H	α-helix	trans	-65.2	-49.1	179.1	-177.8	176.8	-178.9	0	0	112.1	D96	D96-E100 WeakPolarHBondContact O-CB 3.35Å; D96-E100 PolarHBondContact O-N 2.92Å
101	F	97.8	Very high	97.3	Very high	15 Å²	15	50.8 Å²	50.8	7%	0.066	28%	0.277	C	S	.	.	H	α-helix	trans	-96.2	-16.6	-169.3	-65.6	-88	0	0	0	113.9	K48 L49 A52 I68 R72 I97	K48-F101 HydrophobicContact CB-CE1 3.81Å; K48-F101 HydrophobicContact CB-CZ 3.89Å; L49-F101 HydrophobicContact CB-CD1 3.74Å; L49-F101 HydrophobicContact CB-CE1 3.67Å; L49-F101 HydrophobicContact CB-CG 4.28Å; L49-F101 HydrophobicContact CB-CZ 4.16Å; L49-F101 HydrophobicContact CD1-CB 4.16Å; L49-F101 HydrophobicContact CD1-CD1 4.12Å; L49-F101 HydrophobicContact CD1-CD2 3.82Å; L49-F101 HydrophobicContact CD1-CE2 4.24Å; L49-F101 HydrophobicContact CD1-CG 3.76Å; L49-F101 HydrophobicContact CG-CD1 4.36Å; L49-F101 HydrophobicContact CG-CG 4.46Å; L49-F101 VanDerWaalsContact N-CE1 3.33Å; A52-F101 HydrophobicContact CB-CE2 3.87Å; A52-F101 HydrophobicContact CB-CZ 4.3Å; I68-F101 HydrophobicContact CD1-CB 3.74Å; I68-F101 HydrophobicContact CG1-CB 4.48Å; R72-F101 PolarHBondContact NE-O 3.03Å; R72-F101 PolarHBondContact NH2-O 3.34Å; I97-F101 HydrophobicContact CG2-CD2 3.99Å; I97-F101 WeakPolarHBondContact O-CB 3.49Å; I97-F101 VanDerWaalsContact O-CD2 3.27Å; I97-F101 WeakPolarHBondContact O-CD2 3.39Å; I97-F101 PolarHBondContact O-N 3.14Å
102	A	97.3	Very high	96.9	Very high	10 Å²	10	52.9 Å²	52.9	8%	0.083	29%	0.289	C	S	.	.	H	α-helix	trans	-111.1	-7.9	176.5	0	0	0	0	0	114	I68 I71 L98 C104	I68-A102 HydrophobicContact CG1-CB 4.38Å; I68-A102 HydrophobicContact CG2-CB 4.21Å; I71-A102 HydrophobicContact CB-CB 3.89Å; I71-A102 HydrophobicContact CD1-CB 3.99Å; I71-A102 HydrophobicContact CG2-CB 3.56Å; L98-A102 WeakPolarHBondContact O-CA 3.35Å; L98-A102 WeakPolarHBondContact O-CB 3.45Å; L98-A102 PolarHBondContact O-N 3.02Å; A102-C104 VanDerWaalsContact C-N 3.35Å; A102-C104 PolarHBondContact O-N 3.44Å
103	N	96.2	Very high	96.6	Very high	123 Å²	123	49.5 Å²	49.5	66%	0.658	27%	0.266	S	S	*	.			trans	53.5	50.6	-178.7	-169.3	30.4	0	0	0	112.2	E99	E99-N103 WeakPolarHBondContact O-CA 3.36Å; E99-N103 PolarHBondContact O-N 2.9Å; E99-N103 VanDerWaalsContact O-N 3.14Å
104	C	97.9	Very high	96.3	Very high	7 Å²	7	53.4 Å²	53.4	5%	0.047	28%	0.278	C	S	.	.			trans	-123.1	165.7	173.7	63	0	0	0	0	110.1	I71 K77 V79 E99 A102	I71-C104 HydrophobicContact CG2-CB 3.94Å; K77-C104 CarbonylContact O-C 3.25Å; K77-C104 WeakPolarHBondContact O-CA 3.41Å; K77-C104 WeakPolarHBondContact O-CB 3.5Å; V79-C104 HydrophobicContact CG2-CB 4.02Å; E99-C104 WeakPolarHBondContact CA-O 3.43Å; E99-C104 VanDerWaalsContact CG-O 3.3Å; E99-C104 WeakPolarHBondContact CG-O 3.3Å; A102-C104 VanDerWaalsContact C-N 3.35Å; A102-C104 PolarHBondContact O-N 3.44Å
105	N	98.1	Very high	95.8	Very high	99 Å²	99	53.9 Å²	53.9	53%	0.529	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	144.2	165.2	-52.7	-50.4	0	0	0	109.1	K77 N78 V79	K77-N105 PolarHBondContact O-N 3.17Å; N78-N105 WeakPolarHBondContact CA-O 3.18Å; N78-N105 PolarHBondContact OD1-ND2 3.25Å; V79-N105 PolarHBondContact N-O 3.29Å
106	T	98.2	Very high	95.4	Very high	23 Å²	23	54 Å²	54	14%	0.141	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	150.9	176.9	64	0	0	0	0	112.5	V79 L81 A95 L98 E99	V79-T106 HydrophobicContact CB-CG2 4.42Å; V79-T106 CarbonylContact O-C 3.42Å; V79-T106 VanDerWaalsContact O-CA 3.24Å; V79-T106 WeakPolarHBondContact O-CA 3.41Å; L81-T106 HydrophobicContact CD1-CG2 4.19Å; A95-T106 HydrophobicContact CB-CG2 4.44Å; A95-T106 VanDerWaalsContact CB-OG1 3.29Å; A95-T106 WeakPolarHBondContact CB-OG1 3.35Å; L98-T106 HydrophobicContact CB-CG2 4.09Å; E99-T106 HydrophobicContact CG-CG2 3.73Å; E99-T106 WeakPolarHBondContact OE1-CB 3.28Å; E99-T106 PolarHBondContact OE1-N 2.94Å; E99-T106 PolarHBondContact OE1-OG1 2.84Å
107	V	97.4	Very high	95.1	Very high	48 Å²	48	49.9 Å²	49.9	29%	0.291	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	116.6	169.8	179.6	0	0	0	0	107.6	V79 A80 L81 M127	V79-V107 PolarHBondContact O-N 2.95Å; A80-V107 CarbonylContact C-O 3.51Å; A80-V107 WeakPolarHBondContact CA-O 3.39Å; L81-V107 PolarHBondContact N-O 2.67Å; V107-M127 HydrophobicContact CG1-CE 4.3Å; V107-M127 HydrophobicContact CG1-CG 4.48Å; V107-M127 HydrophobicContact CG2-CE 3.99Å
108	I	97.5	Very high	94.8	Very high	52 Å²	52	49.7 Å²	49.7	27%	0.267	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	120	176.6	-61.5	167.4	0	0	0	108.6	L81 L88 A95 T110	L81-I108 HydrophobicContact CD1-CG1 4.47Å; L88-I108 HydrophobicContact CD1-CG2 4.2Å; A95-I108 HydrophobicContact CB-CD1 4.03Å; A95-I108 HydrophobicContact CB-CG1 4.29Å; I108-T110 HydrophobicContact CG2-CG2 4.18Å
109	M	95.4	Very high	94.5	Very high	19 Å²	19	49.7 Å²	49.7	9%	0.094	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	115.4	175.9	-53.7	-179.4	70	0	0	109	A80 L81 Q82 D120 A123 V124 L132	A80-M109 HydrophobicContact CB-CG 4.47Å; A80-M109 HydrophobicContact CB-SD 3.96Å; L81-M109 WeakPolarHBondContact O-CB 3.33Å; L81-M109 PolarHBondContact O-N 3.23Å; Q82-M109 HydrophobicContact CB-CB 4.3Å; Q82-M109 HydrophobicContact CB-SD 3.92Å; Q82-M109 HydrophobicContact CG-CB 4.3Å; Q82-M109 HydrophobicContact CG-SD 4.32Å; M109-D120 HydrophobicContact CE-CB 3.62Å; M109-A123 HydrophobicContact CE-CB 3.71Å; M109-V124 HydrophobicContact CE-CG2 4.44Å; M109-V124 HydrophobicContact SD-CG2 4.11Å; M109-L132 HydrophobicContact SD-CD1 3.87Å
110	T	93.7	Very high	94.1	Very high	99 Å²	99	47.3 Å²	47.3	61%	0.607	25%	0.252	S	S	*	.			trans	-100.9	-5.9	-175.6	56.3	0	0	0	0	113.9	L88 I108	L88-T110 HydrophobicContact CD1-CG2 4.43Å; I108-T110 HydrophobicContact CG2-CG2 4.18Å
111	D	91.5	Very high	93.7	Very high	106 Å²	106	41 Å²	41	57%	0.567	22%	0.223	S	C	*	.	S	Bend	trans	-63.8	149.7	173.6	-74.4	-10.2	0	0	0	110.9	A113	D111-A113 PolarHBondContact O-N 2.88Å
112	V	90.4	Very high	93.4	Very high	53 Å²	53	46 Å²	46	32%	0.321	24%	0.244	S	C	.	.			trans	-65.8	123.1	-171.7	-174.9	0	0	0	0	111.3	Y114	V112-Y114 HydrophobicContact CB-CE2 4.25Å; V112-Y114 HydrophobicContact CG1-CD1 3.85Å; V112-Y114 HydrophobicContact CG1-CD2 3.87Å; V112-Y114 HydrophobicContact CG1-CE1 3.52Å; V112-Y114 HydrophobicContact CG1-CE2 3.53Å; V112-Y114 HydrophobicContact CG1-CG 4.02Å
113	A	91.4	Very high	93.1	Very high	3 Å²	3	47 Å²	47	3%	0.025	25%	0.253	C	S	.	.			trans	-113.4	91.1	171.9	0	0	0	0	0	111.1	Q82 P84 D111 G115 C118	Q82-A113 HydrophobicContact CG-CB 4.16Å; P84-A113 WeakPolarHBondContact CA-O 3.21Å; D111-A113 PolarHBondContact O-N 2.88Å; A113-G115 VanDerWaalsContact C-N 3.25Å; A113-G115 PolarHBondContact O-N 3.28Å; A113-C118 HydrophobicContact CB-CB 4.21Å
114	Y	90.2	Very high	93	Very high	143 Å²	143	41.1 Å²	41.1	56%	0.561	22%	0.222	S	C	*	.			trans	-70	-18.4	178.8	-62.7	-70.1	0	0	0	114.2	V112 L298 E328	V112-Y114 HydrophobicContact CB-CE2 4.25Å; V112-Y114 HydrophobicContact CG1-CD1 3.85Å; V112-Y114 HydrophobicContact CG1-CD2 3.87Å; V112-Y114 HydrophobicContact CG1-CE1 3.52Å; V112-Y114 HydrophobicContact CG1-CE2 3.53Å; V112-Y114 HydrophobicContact CG1-CG 4.02Å; Y114-L298 HydrophobicContact CD2-CD2 3.61Å; Y114-L298 HydrophobicContact CE2-CD2 3.71Å; Y114-E328 PolarHBondContact OH-OE2 2.96Å
115	G	89.7	Confident	92.7	Very high	11 Å²	11	46.4 Å²	46.4	11%	0.113	24%	0.244	C	C	.	.	S	Bend	trans	-176.6	178.8	-173.2	0	0	0	0	0	112.9	A113 C117 C118 H137	A113-G115 VanDerWaalsContact C-N 3.25Å; A113-G115 PolarHBondContact O-N 3.28Å; G115-C117 PolarHBondContact O-N 2.85Å; G115-C118 WeakPolarHBondContact O-CB 3.46Å; G115-C118 PolarHBondContact O-N 3.29Å; G115-H137 VanDerWaalsContact CA-CE1 3.49Å; G115-H137 WeakPolarHBondContact CA-CE1 3.37Å; G115-H137 WeakPolarHBondContact CA-NE2 3.28Å
116	A	89	Confident	92.5	Very high	5 Å²	5	45.7 Å²	45.7	4%	0.041	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.3	-18.2	173.5	0	0	0	0	0	114.4	C118 V119 H137 S138 L140	A116-C118 VanDerWaalsContact C-N 3.29Å; A116-V119 WeakPolarHBondContact O-CG2 3.11Å; A116-H137 HydrophobicContact CB-CB 3.82Å; A116-S138 WeakPolarHBondContact CB-O 3.41Å; A116-L140 HydrophobicContact CB-CB 3.54Å; A116-L140 HydrophobicContact CB-CD2 4.28Å
117	C	91.3	Very high	92.2	Very high	17 Å²	17	49.7 Å²	49.7	12%	0.115	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-76.1	-17.3	175.7	56.2	0	0	0	0	113.1	G115 V119 L140 I141 R300 Q301	G115-C117 PolarHBondContact O-N 2.85Å; C117-V119 VanDerWaalsContact C-N 3.31Å; C117-V119 PolarHBondContact O-N 3.18Å; C117-L140 HydrophobicContact CB-CD2 4.27Å; C117-I141 HydrophobicContact CB-CD1 4.2Å; C117-R300 CarbonylContact O-C 3.59Å; C117-R300 WeakPolarHBondContact O-CA 3.3Å; C117-R300 PolarHBondContact O-N 3.49Å; C117-Q301 HydrophobicContact CB-CG 3.78Å; C117-Q301 PolarHBondContact O-N 2.67Å; C117-Q301 VanDerWaalsContact SG-CG 3.57Å
118	C	92.5	Very high	92.1	Very high	1 Å²	1	53 Å²	53	1%	0.007	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-92.2	18.9	-178.3	-60.4	0	0	0	0	112.9	Q82 A113 G115 A116 D120 L298 Q301	Q82-C118 PolarHBondContact NE2-O 2.73Å; A113-C118 HydrophobicContact CB-CB 4.21Å; G115-C118 WeakPolarHBondContact O-CB 3.46Å; G115-C118 PolarHBondContact O-N 3.29Å; A116-C118 VanDerWaalsContact C-N 3.29Å; C118-D120 PolarHBondContact O-N 2.95Å; C118-D120 VanDerWaalsContact O-N 3.12Å; C118-L298 HydrophobicContact CB-CG 4.28Å; C118-Q301 PolarHBondContact SG-NE2 3.14Å
119	V	92.1	Very high	92	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.276	C	S	.	.			trans	-63.3	119.4	177.1	174.9	0	0	0	0	109.3	A116 C117 D121 L132 L143 Y153 G299	A116-V119 WeakPolarHBondContact O-CG2 3.11Å; C117-V119 VanDerWaalsContact C-N 3.31Å; C117-V119 PolarHBondContact O-N 3.18Å; V119-D121 PolarHBondContact O-N 3.09Å; V119-L132 HydrophobicContact CG1-CD2 3.4Å; V119-L143 HydrophobicContact CB-CD1 3.86Å; V119-L143 HydrophobicContact CB-CD2 4.38Å; V119-L143 HydrophobicContact CG1-CD1 3.34Å; V119-L143 HydrophobicContact CG1-CD2 4.07Å; V119-L143 HydrophobicContact CG1-CG 4.36Å; V119-L143 HydrophobicContact CG2-CD1 3.97Å; V119-Y153 HydrophobicContact CG2-CE1 4.24Å; V119-G299 WeakPolarHBondContact O-CA 3.36Å
120	D	91.2	Very high	92	Very high	25 Å²	25	53.9 Å²	53.9	13%	0.134	29%	0.29	C	S	.	.			trans	-99.2	80.2	-176.7	-179.5	6.6	0	0	0	110.3	M109 C118 F122 A123 V124	M109-D120 HydrophobicContact CE-CB 3.62Å; C118-D120 PolarHBondContact O-N 2.95Å; C118-D120 VanDerWaalsContact O-N 3.12Å; D120-F122 PolarHBondContact O-N 3.28Å; D120-F122 PolarHBondContact OD1-N 2.63Å; D120-F122 VanDerWaalsContact OD1-N 3.17Å; D120-A123 PolarHBondContact OD1-N 2.92Å; D120-A123 WeakPolarHBondContact OD2-CB 3.33Å; D120-V124 WeakPolarHBondContact O-CG2 3.46Å; D120-V124 PolarHBondContact O-N 2.74Å
121	D	89.8	Confident	92.1	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.011	26%	0.261	C	S	.	.	H	α-helix	trans	-75.5	-11.1	175.3	58.5	-20.7	0	0	0	113.5	V119 K125 T146 C147 R300	V119-D121 PolarHBondContact O-N 3.09Å; D121-K125 PolarHBondContact O-N 2.58Å; D121-T146 VanDerWaalsContact OD2-C 3.32Å; D121-T146 WeakPolarHBondContact OD2-CB 3.45Å; D121-T146 PolarHBondContact OD2-OG1 3.4Å; D121-C147 HydrophobicContact CB-CB 3.75Å; D121-C147 VanDerWaalsContact CB-SG 3.53Å; D121-R300 IonicContact OD1-CZ 3.56Å; D121-R300 VanDerWaalsContact OD1-CZ 3.27Å; D121-R300 IonicContact OD1-NE 2.67Å; D121-R300 PolarHBondContact OD1-NE 2.94Å; D121-R300 IonicContact OD1-NH2 2.67Å; D121-R300 PolarHBondContact OD1-NH2 3.5Å; D121-R300 IonicContact OD2-CZ 3.03Å; D121-R300 IonicContact OD2-NE 3.23Å; D121-R300 PolarHBondContact OD2-NE 3.38Å; D121-R300 IonicContact OD2-NH2 2.96Å; D121-R300 PolarHBondContact OD2-NH2 3.24Å
122	F	89.9	Confident	92.4	Very high	119 Å²	119	44.1 Å²	44.1	52%	0.522	23%	0.234	S	C	.	.	H	α-helix	trans	-75	-48.5	175.2	-64.4	-76	0	0	0	111.3	D120 V124 K125 A126	D120-F122 PolarHBondContact O-N 3.28Å; D120-F122 PolarHBondContact OD1-N 2.63Å; D120-F122 VanDerWaalsContact OD1-N 3.17Å; F122-V124 VanDerWaalsContact C-N 3.32Å; F122-V124 PolarHBondContact O-N 3.04Å; F122-K125 WeakPolarHBondContact O-CB 3.37Å; F122-K125 PolarHBondContact O-N 2.86Å; F122-A126 PolarHBondContact O-N 3.34Å
123	A	92	Very high	92.7	Very high	31 Å²	31	41.6 Å²	41.6	26%	0.256	22%	0.218	S	C	.	.	H	α-helix	trans	-64.1	-38.8	175.6	0	0	0	0	0	111.9	M109 D120 K125 A126 M127	M109-A123 HydrophobicContact CE-CB 3.71Å; D120-A123 PolarHBondContact OD1-N 2.92Å; D120-A123 WeakPolarHBondContact OD2-CB 3.33Å; A123-K125 VanDerWaalsContact C-N 3.28Å; A123-K125 PolarHBondContact O-N 3.45Å; A123-A126 PolarHBondContact O-N 3.42Å; A123-A126 VanDerWaalsContact O-N 3.12Å; A123-M127 WeakPolarHBondContact O-CB 3.48Å; A123-M127 WeakPolarHBondContact O-CG 3.35Å; A123-M127 PolarHBondContact O-N 3.37Å
124	V	93.4	Very high	92.9	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-44.2	173.8	172.1	0	0	0	0	111.2	A80 M109 D120 F122 D128 C129 L132 A149	A80-V124 HydrophobicContact CB-CG2 3.79Å; M109-V124 HydrophobicContact CE-CG2 4.44Å; M109-V124 HydrophobicContact SD-CG2 4.11Å; D120-V124 WeakPolarHBondContact O-CG2 3.46Å; D120-V124 PolarHBondContact O-N 2.74Å; F122-V124 VanDerWaalsContact C-N 3.32Å; F122-V124 PolarHBondContact O-N 3.04Å; V124-D128 PolarHBondContact O-N 3.07Å; V124-C129 HydrophobicContact CG1-CB 3.91Å; V124-C129 PolarHBondContact O-N 2.81Å; V124-L132 HydrophobicContact CG1-CB 4.44Å; V124-L132 HydrophobicContact CG2-CB 4.01Å; V124-L132 HydrophobicContact CG2-CD1 3.91Å; V124-L132 HydrophobicContact CG2-CD2 4.14Å; V124-L132 HydrophobicContact CG2-CG 4.22Å; V124-A149 HydrophobicContact CG1-CB 3.38Å
125	K	92.5	Very high	93.2	Very high	117 Å²	117	34.6 Å²	34.6	51%	0.509	19%	0.19	S	C	.	.	H	α-helix	trans	-65.9	-44.8	174.7	-173.2	-166.5	-170.8	161.4	0	111.7	D121 F122 A123 M127 D128 H148	D121-K125 PolarHBondContact O-N 2.58Å; F122-K125 WeakPolarHBondContact O-CB 3.37Å; F122-K125 PolarHBondContact O-N 2.86Å; A123-K125 VanDerWaalsContact C-N 3.28Å; A123-K125 PolarHBondContact O-N 3.45Å; K125-M127 PolarHBondContact O-N 3.17Å; K125-D128 PolarHBondContact O-N 3.28Å; K125-D128 VanDerWaalsContact O-N 3.14Å; K125-H148 WeakPolarHBondContact CD-CD2 3.44Å; K125-H148 WeakPolarHBondContact CD-NE2 3.39Å; K125-H148 WeakPolarHBondContact CE-NE2 3.42Å; K125-H148 HydrophobicContact CG-CB 4.41Å; K125-H148 PolarHBondContact NZ-NE2 2.75Å
126	A	93.1	Very high	93.5	Very high	84 Å²	84	34.1 Å²	34.1	69%	0.694	19%	0.185	S	C	*	.	H	α-helix	trans	-62	-32.3	-178.4	0	0	0	0	0	112.6	F122 A123	F122-A126 PolarHBondContact O-N 3.34Å; A123-A126 PolarHBondContact O-N 3.42Å; A123-A126 VanDerWaalsContact O-N 3.12Å
127	M	93.2	Very high	93.7	Very high	107 Å²	107	35 Å²	35	53%	0.527	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	8.8	178.1	-64.3	-59	-64.4	0	0	113.9	V107 A123 K125 C129	V107-M127 HydrophobicContact CG1-CE 4.3Å; V107-M127 HydrophobicContact CG1-CG 4.48Å; V107-M127 HydrophobicContact CG2-CE 3.99Å; A123-M127 WeakPolarHBondContact O-CB 3.48Å; A123-M127 WeakPolarHBondContact O-CG 3.35Å; A123-M127 PolarHBondContact O-N 3.37Å; K125-M127 PolarHBondContact O-N 3.17Å; M127-C129 PolarHBondContact O-N 2.98Å; M127-C129 VanDerWaalsContact O-N 3.12Å
128	D	94.3	Very high	93.7	Very high	118 Å²	118	34.5 Å²	34.5	63%	0.631	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.9	40.9	-177.7	-164.6	38.1	0	0	0	113.3	N78 V124 K125	N78-D128 WeakPolarHBondContact CB-O 3.31Å; N78-D128 PolarHBondContact ND2-O 2.92Å; V124-D128 PolarHBondContact O-N 3.07Å; K125-D128 PolarHBondContact O-N 3.28Å; K125-D128 VanDerWaalsContact O-N 3.14Å
129	C	95.9	Very high	93.5	Very high	8 Å²	8	37.9 Å²	37.9	5%	0.054	21%	0.208	C	C	.	.			trans	-82.1	135.6	176.5	-72.4	0	0	0	0	110	A80 V124 M127 A149	A80-C129 HydrophobicContact CB-CB 3.97Å; V124-C129 HydrophobicContact CG1-CB 3.91Å; V124-C129 PolarHBondContact O-N 2.81Å; M127-C129 PolarHBondContact O-N 2.98Å; M127-C129 VanDerWaalsContact O-N 3.12Å; C129-A149 WeakPolarHBondContact O-CB 3.41Å
130	Q	95.6	Very high	93.2	Very high	81 Å²	81	38.4 Å²	38.4	38%	0.379	21%	0.211	S	C	.	.	S	Bend	trans	-96.4	-17.3	-177.7	-59.8	147.6	-48.3	0	0	112.1	I76 N78 Q150	I76-Q130 HydrophobicContact CG1-CB 4.33Å; I76-Q130 HydrophobicContact CG2-CB 4.13Å; N78-Q130 VanDerWaalsContact N-OE1 3.09Å; N78-Q130 PolarHBondContact O-N 3.48Å; Q130-Q150 PolarHBondContact O-N 2.87Å
131	L	96.2	Very high	92.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	130.1	174.5	179.3	67	0	0	0	110.1	K70 I71 I76 N78 V79 A80 V133 Q150 L152	K70-L131 HydrophobicContact CG-CD2 4.44Å; I71-L131 HydrophobicContact CD1-CD2 4.33Å; I71-L131 HydrophobicContact CG1-CD2 3.64Å; I76-L131 HydrophobicContact CD1-CB 3.81Å; I76-L131 HydrophobicContact CD1-CD2 4.05Å; I76-L131 HydrophobicContact CD1-CG 4.34Å; I76-L131 HydrophobicContact CG1-CB 4.47Å; I76-L131 HydrophobicContact CG2-CB 3.92Å; N78-L131 PolarHBondContact O-N 2.67Å; V79-L131 CarbonylContact C-O 3.58Å; V79-L131 WeakPolarHBondContact CA-O 3.3Å; V79-L131 HydrophobicContact CG1-CB 4.35Å; V79-L131 HydrophobicContact CG1-CD2 4.09Å; V79-L131 HydrophobicContact CG1-CG 4.28Å; V79-L131 HydrophobicContact CG2-CB 4.39Å; V79-L131 HydrophobicContact CG2-CD2 4.4Å; A80-L131 PolarHBondContact N-O 2.8Å; L131-V133 HydrophobicContact CD2-CG2 3.87Å; L131-V133 HydrophobicContact CG-CG2 4.03Å; L131-Q150 CarbonylContact C-O 3.48Å; L131-Q150 WeakPolarHBondContact CA-O 3.19Å; L131-Q150 HydrophobicContact CD1-CB 4.06Å; L131-L152 HydrophobicContact CD1-CB 3.99Å
132	L	95.8	Very high	92	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.8	161.7	170.9	63.3	0	0	0	108.7	A80 Q82 M109 V119 V124 H134 Q150 V151 L152	A80-L132 HydrophobicContact CB-CD1 3.95Å; A80-L132 CarbonylContact O-C 3.58Å; A80-L132 WeakPolarHBondContact O-CA 3.47Å; Q82-L132 HydrophobicContact CB-CD1 3.87Å; M109-L132 HydrophobicContact SD-CD1 3.87Å; V119-L132 HydrophobicContact CG1-CD2 3.4Å; V124-L132 HydrophobicContact CG1-CB 4.44Å; V124-L132 HydrophobicContact CG2-CB 4.01Å; V124-L132 HydrophobicContact CG2-CD1 3.91Å; V124-L132 HydrophobicContact CG2-CD2 4.14Å; V124-L132 HydrophobicContact CG2-CG 4.22Å; L132-H134 HydrophobicContact CG-CB 4.5Å; L132-Q150 PolarHBondContact N-O 2.81Å; L132-V151 HydrophobicContact CB-CG1 4.45Å; L132-V151 HydrophobicContact CB-CG2 4.38Å; L132-V151 HydrophobicContact CD2-CG1 4.11Å; L132-V151 HydrophobicContact CD2-CG2 4.42Å; L132-V151 HydrophobicContact CG-CG1 4.32Å; L132-V151 CarbonylContact O-C 3.36Å; L132-V151 WeakPolarHBondContact O-CA 3.27Å; L132-L152 PolarHBondContact O-N 3.21Å
133	V	96.8	Very high	91.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	108.6	167.1	-166.7	0	0	0	0	108.2	T67 V79 A80 L81 Q82 L131 Y135 L152 V154	T67-V133 HydrophobicContact CG2-CG1 4.44Å; T67-V133 HydrophobicContact CG2-CG2 3.81Å; V79-V133 HydrophobicContact CG1-CG2 3.8Å; A80-V133 PolarHBondContact O-N 2.93Å; L81-V133 HydrophobicContact CD2-CB 3.88Å; L81-V133 HydrophobicContact CD2-CG2 3.96Å; Q82-V133 PolarHBondContact N-O 3.06Å; L131-V133 HydrophobicContact CD2-CG2 3.87Å; L131-V133 HydrophobicContact CG-CG2 4.03Å; V133-Y135 HydrophobicContact CB-CE2 3.88Å; V133-Y135 HydrophobicContact CG1-CD2 4.03Å; V133-Y135 HydrophobicContact CG1-CE1 4.19Å; V133-Y135 HydrophobicContact CG1-CE2 3.38Å; V133-Y135 VanDerWaalsContact CG1-CZ 3.47Å; V133-L152 CarbonylContact C-O 3.48Å; V133-L152 WeakPolarHBondContact CA-O 3.36Å; V133-L152 HydrophobicContact CG1-CD2 4.34Å; V133-L152 HydrophobicContact CG1-CG 4.43Å; V133-V154 HydrophobicContact CG1-CG2 3.8Å
134	H	95.8	Very high	90.1	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	111.1	-179.5	-173	86.9	0	0	0	109.6	Q82 L132 H137 L152 Y153 V154	Q82-H134 PolarHBondContact OE1-CE1 2.86Å; Q82-H134 VanDerWaalsContact OE1-CE1 3.3Å; Q82-H134 PolarHBondContact OE1-ND1 2.78Å; L132-H134 HydrophobicContact CG-CB 4.5Å; H134-H137 AromaticContact CD2-ND1 3.8Å; H134-H137 AromaticContact CE1-ND1 3.76Å; H134-H137 AromaticContact NE2-CG 3.64Å; H134-H137 AromaticContact NE2-ND1 2.9Å; H134-H137 PolarHBondContact NE2-ND1 3.23Å; H134-L152 PolarHBondContact N-O 2.78Å; H134-Y153 HydrophobicContact CB-CD1 4.14Å; H134-Y153 HydrophobicContact CB-CE1 4.28Å; H134-Y153 AromaticContact CD2-CD1 3.78Å; H134-Y153 AromaticContact CD2-CE1 3.73Å; H134-Y153 WeakPolarHBondContact O-CA 3.31Å; H134-V154 PolarHBondContact O-N 2.89Å
135	Y	97.2	Very high	88.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	150.7	-176.7	-70.3	-88.4	0	0	0	112.2	F62 L81 Q82 F83 P84 I94 V133 H137 V154 V156	F62-Y135 HydrophobicContact CB-CE1 4.21Å; F62-Y135 AromaticContact CD1-CD1 4Å; F62-Y135 HydrophobicContact CD1-CD1 4Å; F62-Y135 HydrophobicContact CD1-CE1 4.05Å; L81-Y135 HydrophobicContact CD2-CE2 4.34Å; Q82-Y135 PolarHBondContact O-N 3.43Å; F83-Y135 AromaticContact CD1-CD2 3.59Å; F83-Y135 HydrophobicContact CD1-CD2 3.59Å; F83-Y135 HydrophobicContact CD1-CE2 4.35Å; F83-Y135 AromaticContact CD1-CG 3.82Å; F83-Y135 HydrophobicContact CD1-CG 3.82Å; F83-Y135 HydrophobicContact CE1-CD1 4.36Å; F83-Y135 AromaticContact CE1-CD2 3.2Å; F83-Y135 HydrophobicContact CE1-CD2 3.2Å; F83-Y135 AromaticContact CE1-CE2 3.51Å; F83-Y135 HydrophobicContact CE1-CE2 3.51Å; F83-Y135 AromaticContact CE1-CG 3.68Å; F83-Y135 HydrophobicContact CE1-CG 3.68Å; F83-Y135 HydrophobicContact CE2-CD2 4.47Å; F83-Y135 HydrophobicContact CG-CD2 4.37Å; F83-Y135 AromaticContact CZ-CD2 3.71Å; F83-Y135 HydrophobicContact CZ-CD2 3.71Å; F83-Y135 AromaticContact CZ-CE2 3.67Å; F83-Y135 HydrophobicContact CZ-CE2 3.67Å; P84-Y135 VanDerWaalsContact CD-O 3.24Å; P84-Y135 WeakPolarHBondContact CD-O 3.36Å; I94-Y135 WeakPolarHBondContact CG2-OH 3.31Å; V133-Y135 HydrophobicContact CB-CE2 3.88Å; V133-Y135 HydrophobicContact CG1-CD2 4.03Å; V133-Y135 HydrophobicContact CG1-CE1 4.19Å; V133-Y135 HydrophobicContact CG1-CE2 3.38Å; V133-Y135 VanDerWaalsContact CG1-CZ 3.47Å; Y135-H137 PolarHBondContact O-N 3.15Å; Y135-H137 PolarHBondContact O-ND1 3.05Å; Y135-V154 CarbonylContact C-O 3.54Å; Y135-V154 WeakPolarHBondContact CA-O 3.41Å; Y135-V154 HydrophobicContact CD1-CB 3.61Å; Y135-V154 HydrophobicContact CD1-CG1 3.66Å; Y135-V154 HydrophobicContact CD1-CG2 4.24Å; Y135-V154 HydrophobicContact CE1-CB 3.81Å; Y135-V154 HydrophobicContact CE1-CG1 3.77Å; Y135-V154 HydrophobicContact CE1-CG2 3.95Å; Y135-V154 HydrophobicContact CG-CB 4.38Å; Y135-V156 HydrophobicContact CD1-CG2 3.89Å
136	G	95	Very high	87.6	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.01	25%	0.252	C	S	.	.	S	Bend	trans	83.8	-6.2	166.3	0	0	0	0	0	116.2	V154 F155 V185 Q186	G136-V154 PolarHBondContact N-O 3.34Å; G136-F155 WeakPolarHBondContact CA-O 3.39Å; G136-V185 WeakPolarHBondContact O-CG1 3.44Å; G136-Q186 PolarHBondContact O-NE2 3Å
137	H	93.7	Very high	86.8	Confident	24 Å²	24	41 Å²	41	11%	0.111	22%	0.224	C	C	.	.			trans	-133.7	154.1	-175.9	-49.9	115	0	0	0	113.4	G115 A116 H134 Y135 Y153 F155	G115-H137 VanDerWaalsContact CA-CE1 3.49Å; G115-H137 WeakPolarHBondContact CA-CE1 3.37Å; G115-H137 WeakPolarHBondContact CA-NE2 3.28Å; A116-H137 HydrophobicContact CB-CB 3.82Å; H134-H137 AromaticContact CD2-ND1 3.8Å; H134-H137 AromaticContact CE1-ND1 3.76Å; H134-H137 AromaticContact NE2-CG 3.64Å; H134-H137 AromaticContact NE2-ND1 2.9Å; H134-H137 PolarHBondContact NE2-ND1 3.23Å; Y135-H137 PolarHBondContact O-N 3.15Å; Y135-H137 PolarHBondContact O-ND1 3.05Å; H137-Y153 WeakPolarHBondContact O-CD1 3.28Å; H137-F155 VanDerWaalsContact O-CD1 3.32Å; H137-F155 WeakPolarHBondContact O-CD1 3.45Å
138	S	91.4	Very high	86.2	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.042	23%	0.229	C	C	.	.			trans	-78.7	161.1	169.9	63.3	0	0	0	0	111.5	A116 L140 E216	A116-S138 WeakPolarHBondContact CB-O 3.41Å; S138-L140 PolarHBondContact O-N 3.08Å; S138-E216 VanDerWaalsContact CB-OE1 3.26Å; S138-E216 WeakPolarHBondContact CB-OE1 3.46Å; S138-E216 PolarHBondContact OG-OE1 2.92Å
139	C	89.3	Confident	85.9	Confident	71 Å²	71	37.1 Å²	37.1	48%	0.48	20%	0.203	S	C	.	.			trans	-71	117.8	175.1	-175.9	0	0	0	0	110.6	I141 Y153	C139-I141 PolarHBondContact SG-O 2.93Å; C139-Y153 HydrophobicContact CB-CD2 3.8Å; C139-Y153 HydrophobicContact CB-CE1 4.36Å; C139-Y153 HydrophobicContact CB-CE2 3.63Å; C139-Y153 HydrophobicContact CB-CG 4.22Å; C139-Y153 VanDerWaalsContact SG-CE2 3.58Å
140	L	84.8	Confident	85.7	Confident	12 Å²	12	40.5 Å²	40.5	6%	0.063	22%	0.218	C	C	.	.			trans	-109.1	-30	179.5	-173.8	62.5	0	0	0	113.1	A116 C117 S138 L212 L218 Y387	A116-L140 HydrophobicContact CB-CB 3.54Å; A116-L140 HydrophobicContact CB-CD2 4.28Å; C117-L140 HydrophobicContact CB-CD2 4.27Å; S138-L140 PolarHBondContact O-N 3.08Å; L140-L212 HydrophobicContact CD1-CD2 3.91Å; L140-L218 HydrophobicContact CD1-CD1 3.75Å; L140-L218 HydrophobicContact CD2-CD1 3.78Å; L140-L218 HydrophobicContact CG-CD1 4.37Å; L140-Y387 HydrophobicContact CD1-CD1 4Å; L140-Y387 HydrophobicContact CD1-CD2 4.39Å; L140-Y387 HydrophobicContact CD1-CG 3.81Å; L140-Y387 HydrophobicContact CD2-CD1 4.1Å; L140-Y387 HydrophobicContact CD2-CD2 3.83Å; L140-Y387 HydrophobicContact CD2-CE1 4.08Å; L140-Y387 HydrophobicContact CD2-CE2 3.8Å; L140-Y387 HydrophobicContact CD2-CG 3.97Å; L140-Y387 HydrophobicContact CG-CD1 3.83Å; L140-Y387 HydrophobicContact CG-CD2 4.37Å; L140-Y387 HydrophobicContact CG-CE1 4.07Å; L140-Y387 HydrophobicContact CG-CG 3.99Å
141	I	80.7	Confident	85.5	Confident	18 Å²	18	38.5 Å²	38.5	9%	0.092	21%	0.211	C	C	.	.	S	Bend	trans	-118.2	137.5	-169.6	-59.6	-177.1	0	0	0	108.7	C117 C139 L143 R300 Y387	C117-I141 HydrophobicContact CB-CD1 4.2Å; C139-I141 PolarHBondContact SG-O 2.93Å; I141-L143 HydrophobicContact CG2-CD2 4.15Å; I141-L143 PolarHBondContact O-N 3.36Å; I141-R300 HydrophobicContact CD1-CB 3.34Å; I141-R300 HydrophobicContact CD1-CG 4.46Å; I141-R300 WeakPolarHBondContact CD1-O 3.49Å; I141-R300 HydrophobicContact CG2-CB 4.12Å; I141-R300 HydrophobicContact CG2-CG 4.4Å; I141-Y387 HydrophobicContact CG1-CE1 4.32Å
142	P	75.3	Confident	85.4	Confident	64 Å²	64	39.4 Å²	39.4	42%	0.416	22%	0.216	S	C	.	.			trans	-72.3	73.6	-179.1	31.2	-36.5	0	0	0	111.5	N144 I145	P142-N144 PolarHBondContact O-N 3.07Å; P142-I145 HydrophobicContact CB-CD1 4.46Å; P142-I145 PolarHBondContact O-N 3.2Å
143	L	74.5	Confident	85.3	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-69.9	-15.9	-177.6	-66.4	177.8	0	0	0	113.5	V119 I141 I145 T146 C147 V151 Y153 R300	V119-L143 HydrophobicContact CB-CD1 3.86Å; V119-L143 HydrophobicContact CB-CD2 4.38Å; V119-L143 HydrophobicContact CG1-CD1 3.34Å; V119-L143 HydrophobicContact CG1-CD2 4.07Å; V119-L143 HydrophobicContact CG1-CG 4.36Å; V119-L143 HydrophobicContact CG2-CD1 3.97Å; I141-L143 HydrophobicContact CG2-CD2 4.15Å; I141-L143 PolarHBondContact O-N 3.36Å; L143-I145 PolarHBondContact O-N 2.89Å; L143-T146 WeakPolarHBondContact CD2-OG1 3.37Å; L143-T146 PolarHBondContact O-N 3.31Å; L143-C147 HydrophobicContact CB-CB 4.07Å; L143-C147 VanDerWaalsContact O-CB 3.26Å; L143-C147 WeakPolarHBondContact O-CB 3.42Å; L143-C147 PolarHBondContact O-N 3.08Å; L143-V151 HydrophobicContact CB-CG2 4.1Å; L143-V151 HydrophobicContact CD1-CB 4.31Å; L143-V151 HydrophobicContact CD1-CG1 3.97Å; L143-V151 HydrophobicContact CD1-CG2 3.89Å; L143-Y153 HydrophobicContact CD1-CE2 4.19Å; L143-Y153 WeakPolarHBondContact CD1-OH 3.16Å; L143-R300 HydrophobicContact CD2-CG 4.43Å
144	N	68.1	Low	85.3	Confident	142 Å²	142	40.7 Å²	40.7	76%	0.759	22%	0.221	S	C	*	.	H	α-helix	trans	-62.7	-11.9	174.4	66.9	-50.3	0	0	0	113.3	P142	P142-N144 PolarHBondContact O-N 3.07Å
145	I	64.7	Low	85.2	Confident	138 Å²	138	44.4 Å²	44.4	71%	0.708	24%	0.237	S	C	*	.	H	α-helix	trans	-106.1	-28.5	177.4	-53.9	171.6	0	0	0	111	P142 L143	P142-I145 HydrophobicContact CB-CD1 4.46Å; P142-I145 PolarHBondContact O-N 3.2Å; L143-I145 PolarHBondContact O-N 2.89Å
146	T	69	Low	85.1	Confident	49 Å²	49	44.5 Å²	44.5	30%	0.301	24%	0.238	S	C	.	.	H	α-helix	trans	-106.1	-30.6	-171	67.3	0	0	0	0	114.1	D121 L143	D121-T146 VanDerWaalsContact OD2-C 3.32Å; D121-T146 WeakPolarHBondContact OD2-CB 3.45Å; D121-T146 PolarHBondContact OD2-OG1 3.4Å; L143-T146 WeakPolarHBondContact CD2-OG1 3.37Å; L143-T146 PolarHBondContact O-N 3.31Å
147	C	76.1	Confident	85	Confident	16 Å²	16	45.9 Å²	45.9	11%	0.108	25%	0.245	C	C	.	.			trans	-89.4	130.6	-176.4	-169.4	0	0	0	0	110.2	D121 L143 A149 V151	D121-C147 HydrophobicContact CB-CB 3.75Å; D121-C147 VanDerWaalsContact CB-SG 3.53Å; L143-C147 HydrophobicContact CB-CB 4.07Å; L143-C147 VanDerWaalsContact O-CB 3.26Å; L143-C147 WeakPolarHBondContact O-CB 3.42Å; L143-C147 PolarHBondContact O-N 3.08Å; C147-A149 PolarHBondContact O-N 3.26Å; C147-V151 HydrophobicContact CB-CG2 4.02Å
148	H	80.4	Confident	85.1	Confident	133 Å²	133	45.4 Å²	45.4	62%	0.616	24%	0.243	S	C	*	.	S	Bend	trans	-73.1	-19.4	175.5	-68.9	-79.8	0	0	0	112.8	K125	K125-H148 WeakPolarHBondContact CD-CD2 3.44Å; K125-H148 WeakPolarHBondContact CD-NE2 3.39Å; K125-H148 WeakPolarHBondContact CE-NE2 3.42Å; K125-H148 HydrophobicContact CG-CB 4.41Å; K125-H148 PolarHBondContact NZ-NE2 2.75Å
149	A	88	Confident	85.2	Confident	11 Å²	11	49.4 Å²	49.4	9%	0.091	26%	0.26	C	S	.	.	S	Bend	trans	-97.3	162.3	177.5	0	0	0	0	0	111.4	V124 C129 C147	V124-A149 HydrophobicContact CG1-CB 3.38Å; C129-A149 WeakPolarHBondContact O-CB 3.41Å; C147-A149 PolarHBondContact O-N 3.26Å
150	Q	91.8	Very high	85.4	Confident	78 Å²	78	47.3 Å²	47.3	36%	0.364	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	145.5	161.3	-62.1	-171.1	43.9	0	0	109.4	Q74 Q130 L131 L132	Q74-Q150 VanDerWaalsContact CD-NE2 3.27Å; Q74-Q150 VanDerWaalsContact NE2-NE2 3.12Å; Q130-Q150 PolarHBondContact O-N 2.87Å; L131-Q150 CarbonylContact C-O 3.48Å; L131-Q150 WeakPolarHBondContact CA-O 3.19Å; L131-Q150 HydrophobicContact CD1-CB 4.06Å; L132-Q150 PolarHBondContact N-O 2.81Å
151	V	92.1	Very high	85.9	Confident	40 Å²	40	48.5 Å²	48.5	24%	0.242	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.2	178	-171.7	0	0	0	0	109.4	L132 L143 C147 Y153	L132-V151 HydrophobicContact CB-CG1 4.45Å; L132-V151 HydrophobicContact CB-CG2 4.38Å; L132-V151 HydrophobicContact CD2-CG1 4.11Å; L132-V151 HydrophobicContact CD2-CG2 4.42Å; L132-V151 HydrophobicContact CG-CG1 4.32Å; L132-V151 CarbonylContact O-C 3.36Å; L132-V151 WeakPolarHBondContact O-CA 3.27Å; L143-V151 HydrophobicContact CB-CG2 4.1Å; L143-V151 HydrophobicContact CD1-CB 4.31Å; L143-V151 HydrophobicContact CD1-CG1 3.97Å; L143-V151 HydrophobicContact CD1-CG2 3.89Å; C147-V151 HydrophobicContact CB-CG2 4.02Å; V151-Y153 HydrophobicContact CB-CE2 4.32Å; V151-Y153 HydrophobicContact CG1-CD2 3.87Å; V151-Y153 HydrophobicContact CG1-CE2 3.55Å
152	L	93.9	Very high	86.7	Confident	19 Å²	19	49.3 Å²	49.3	10%	0.099	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	109.8	171.2	176	61.7	0	0	0	108.7	K66 T67 L131 L132 V133 H134 V154	K66-L152 HydrophobicContact CD-CD1 4.48Å; T67-L152 HydrophobicContact CG2-CD2 4.17Å; T67-L152 WeakPolarHBondContact OG1-CD2 3.47Å; L131-L152 HydrophobicContact CD1-CB 3.99Å; L132-L152 PolarHBondContact O-N 3.21Å; V133-L152 CarbonylContact C-O 3.48Å; V133-L152 WeakPolarHBondContact CA-O 3.36Å; V133-L152 HydrophobicContact CG1-CD2 4.34Å; V133-L152 HydrophobicContact CG1-CG 4.43Å; H134-L152 PolarHBondContact N-O 2.78Å; L152-V154 HydrophobicContact CD2-CG2 4.43Å; L152-V154 HydrophobicContact CG-CG2 4.2Å
153	Y	93.7	Very high	87.7	Confident	26 Å²	26	48.9 Å²	48.9	10%	0.102	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	127.2	169.8	-71.8	-92.6	0	0	0	109.9	V119 H134 H137 C139 L143 V151	V119-Y153 HydrophobicContact CG2-CE1 4.24Å; H134-Y153 HydrophobicContact CB-CD1 4.14Å; H134-Y153 HydrophobicContact CB-CE1 4.28Å; H134-Y153 AromaticContact CD2-CD1 3.78Å; H134-Y153 AromaticContact CD2-CE1 3.73Å; H134-Y153 WeakPolarHBondContact O-CA 3.31Å; H137-Y153 WeakPolarHBondContact O-CD1 3.28Å; C139-Y153 HydrophobicContact CB-CD2 3.8Å; C139-Y153 HydrophobicContact CB-CE1 4.36Å; C139-Y153 HydrophobicContact CB-CE2 3.63Å; C139-Y153 HydrophobicContact CB-CG 4.22Å; C139-Y153 VanDerWaalsContact SG-CE2 3.58Å; L143-Y153 HydrophobicContact CD1-CE2 4.19Å; L143-Y153 WeakPolarHBondContact CD1-OH 3.16Å; V151-Y153 HydrophobicContact CB-CE2 4.32Å; V151-Y153 HydrophobicContact CG1-CD2 3.87Å; V151-Y153 HydrophobicContact CG1-CE2 3.55Å
154	V	95.5	Very high	88.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	109	171.6	177.9	0	0	0	0	107.1	F62 E63 V133 H134 Y135 G136 L152 V156	F62-V154 WeakPolarHBondContact O-CG1 3.45Å; E63-V154 HydrophobicContact CB-CG1 4.06Å; E63-V154 HydrophobicContact CB-CG2 4.41Å; E63-V154 HydrophobicContact CG-CG1 4.09Å; V133-V154 HydrophobicContact CG1-CG2 3.8Å; H134-V154 PolarHBondContact O-N 2.89Å; Y135-V154 CarbonylContact C-O 3.54Å; Y135-V154 WeakPolarHBondContact CA-O 3.41Å; Y135-V154 HydrophobicContact CD1-CB 3.61Å; Y135-V154 HydrophobicContact CD1-CG1 3.66Å; Y135-V154 HydrophobicContact CD1-CG2 4.24Å; Y135-V154 HydrophobicContact CE1-CB 3.81Å; Y135-V154 HydrophobicContact CE1-CG1 3.77Å; Y135-V154 HydrophobicContact CE1-CG2 3.95Å; Y135-V154 HydrophobicContact CG-CB 4.38Å; G136-V154 PolarHBondContact N-O 3.34Å; L152-V154 HydrophobicContact CD2-CG2 4.43Å; L152-V154 HydrophobicContact CG-CG2 4.2Å; V154-V156 HydrophobicContact CG1-CG2 3.98Å; V154-V156 PolarHBondContact O-N 2.78Å
155	F	94.3	Very high	90.2	Very high	79 Å²	79	44.3 Å²	44.3	35%	0.346	23%	0.228	S	C	.	.			trans	-68.7	-22.7	-172.8	-59	-11.1	0	0	0	112.9	G136 H137 V185	G136-F155 WeakPolarHBondContact CA-O 3.39Å; H137-F155 VanDerWaalsContact O-CD1 3.32Å; H137-F155 WeakPolarHBondContact O-CD1 3.45Å; F155-V185 HydrophobicContact CB-CG2 3.91Å; F155-V185 HydrophobicContact CD1-CG2 4.26Å; F155-V185 HydrophobicContact CD2-CG2 3.73Å; F155-V185 HydrophobicContact CE2-CG2 4.3Å; F155-V185 HydrophobicContact CG-CG2 3.71Å
156	V	95	Very high	91.7	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	20%	0.195	C	C	.	.			trans	59.8	70.9	-173.1	-166	0	0	0	0	110.6	Y60 N61 F62 L87 Y135 V154 I158 Q186	Y60-V156 HydrophobicContact CD1-CG1 3.63Å; Y60-V156 HydrophobicContact CG-CG1 4.15Å; N61-V156 WeakPolarHBondContact O-CA 3.21Å; F62-V156 HydrophobicContact CD1-CG1 4.34Å; F62-V156 HydrophobicContact CD1-CG2 4.22Å; F62-V156 HydrophobicContact CE1-CG1 4.19Å; F62-V156 HydrophobicContact CE1-CG2 4.47Å; L87-V156 HydrophobicContact CD1-CB 4.2Å; L87-V156 HydrophobicContact CD1-CG1 4.21Å; L87-V156 HydrophobicContact CD1-CG2 3.77Å; Y135-V156 HydrophobicContact CD1-CG2 3.89Å; V154-V156 HydrophobicContact CG1-CG2 3.98Å; V154-V156 PolarHBondContact O-N 2.78Å; V156-I158 PolarHBondContact O-N 3.5Å; V156-Q186 WeakPolarHBondContact O-CB 3.24Å
157	D	93.8	Very high	93.1	Very high	30 Å²	30	39.7 Å²	39.7	16%	0.16	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	125.6	174.3	-172.4	144	0	0	0	110	N61 Q186 S189	N61-D157 HydrophobicContact CB-CB 4.16Å; N61-D157 PolarHBondContact N-O 2.85Å; D157-Q186 WeakPolarHBondContact CA-O 3.46Å; D157-S189 WeakPolarHBondContact OD1-CB 3.38Å; D157-S189 PolarHBondContact OD1-OG 3Å; D157-S189 PolarHBondContact OD2-OG 3.24Å
158	I	94.7	Very high	94.1	Very high	13 Å²	13	39.8 Å²	39.8	7%	0.067	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117	-177.3	-61	168.4	0	0	0	109.7	T59 Y60 V156 Q186 F187	T59-I158 WeakPolarHBondContact O-CA 3.35Å; Y60-I158 HydrophobicContact CD1-CD1 4.14Å; Y60-I158 HydrophobicContact CD1-CG1 3.65Å; Y60-I158 HydrophobicContact CE1-CD1 3.74Å; Y60-I158 HydrophobicContact CE1-CG1 3.74Å; V156-I158 PolarHBondContact O-N 3.5Å; I158-Q186 HydrophobicContact CD1-CB 3.57Å; I158-Q186 HydrophobicContact CD1-CG 4.06Å; I158-Q186 HydrophobicContact CG1-CB 3.9Å; I158-Q186 PolarHBondContact N-O 2.73Å; I158-F187 HydrophobicContact CB-CD1 3.95Å; I158-F187 HydrophobicContact CB-CE1 3.58Å; I158-F187 HydrophobicContact CB-CZ 4.24Å; I158-F187 HydrophobicContact CD1-CE1 4.08Å; I158-F187 HydrophobicContact CD1-CE2 4.43Å; I158-F187 HydrophobicContact CD1-CZ 3.84Å; I158-F187 HydrophobicContact CG1-CE1 4.42Å; I158-F187 HydrophobicContact CG2-CD1 4.31Å; I158-F187 HydrophobicContact CG2-CE1 3.56Å; I158-F187 HydrophobicContact CG2-CZ 4.25Å
159	K	93.3	Very high	94.9	Very high	90 Å²	90	33.5 Å²	33.5	39%	0.391	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-76.5	131.2	177.2	-60.5	174.8	-166.4	141.7	0	111	D58 T59	D58-K159 PolarHBondContact O-NZ 2.74Å; T59-K159 PolarHBondContact O-N 3.43Å
160	F	94.9	Very high	95.4	Very high	27 Å²	27	37.8 Å²	37.8	12%	0.118	19%	0.188	C	C	.	.			trans	-142.5	176.7	170.1	68.7	-83.5	0	0	0	111.2	I162 L165 F187 S190 I235 Y257 P259	F160-I162 PolarHBondContact O-N 2.75Å; F160-L165 HydrophobicContact CE2-CB 4.1Å; F160-L165 HydrophobicContact CE2-CD2 3.74Å; F160-L165 HydrophobicContact CZ-CD2 3.96Å; F160-F187 AromaticContact CD1-CD1 3.75Å; F160-F187 HydrophobicContact CD1-CD1 3.75Å; F160-F187 HydrophobicContact CD1-CE1 4.28Å; F160-F187 HydrophobicContact CE1-CB 4.19Å; F160-F187 AromaticContact CE1-CD1 3.79Å; F160-F187 HydrophobicContact CE1-CD1 3.79Å; F160-F187 HydrophobicContact CE1-CG 4.44Å; F160-S190 VanDerWaalsContact CE1-CB 3.49Å; F160-S190 VanDerWaalsContact CE1-OG 3.24Å; F160-S190 WeakPolarHBondContact CE1-OG 3.31Å; F160-S190 VanDerWaalsContact CZ-OG 3.26Å; F160-S190 WeakPolarHBondContact CZ-OG 3.42Å; F160-I235 HydrophobicContact CE1-CG2 4.35Å; F160-I235 HydrophobicContact CZ-CG2 4.05Å; F160-Y257 HydrophobicContact CD2-CE1 4.16Å; F160-Y257 HydrophobicContact CE2-CE1 4.06Å; F160-P259 HydrophobicContact CB-CB 3.65Å; F160-P259 HydrophobicContact CD1-CB 4.2Å; F160-P259 HydrophobicContact CD1-CG 4.42Å; F160-P259 HydrophobicContact CD2-CB 3.97Å; F160-P259 HydrophobicContact CD2-CG 4.44Å; F160-P259 HydrophobicContact CG-CB 3.69Å; F160-P259 HydrophobicContact CG-CG 4.28Å
161	S	95.4	Very high	95.6	Very high	37 Å²	37	42.6 Å²	42.6	26%	0.259	21%	0.208	S	C	.	.			trans	-76.9	101.7	178.9	-172.5	0	0	0	0	111	S163 H164 L165	S161-S163 PolarHBondContact OG-OG 2.87Å; S161-H164 PolarHBondContact O-N 2.68Å; S161-H164 PolarHBondContact OG-N 3.24Å; S161-L165 PolarHBondContact O-N 3Å
162	I	95.7	Very high	95.8	Very high	36 Å²	36	44.8 Å²	44.8	19%	0.185	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-43.5	175.1	-65.7	174.3	0	0	0	110.4	F160 H164 L165 V166 A193 V194	F160-I162 PolarHBondContact O-N 2.75Å; I162-H164 VanDerWaalsContact C-N 3.27Å; I162-H164 PolarHBondContact O-N 3Å; I162-L165 WeakPolarHBondContact O-CA 3.32Å; I162-L165 WeakPolarHBondContact O-CB 3.49Å; I162-L165 PolarHBondContact O-N 3.23Å; I162-V166 HydrophobicContact CG2-CG2 4.15Å; I162-V166 WeakPolarHBondContact O-CG2 3.32Å; I162-V166 PolarHBondContact O-N 3.06Å; I162-A193 HydrophobicContact CD1-CB 3.83Å; I162-V194 HydrophobicContact CG2-CG2 3.94Å
163	S	96.4	Very high	95.9	Very high	54 Å²	54	44.7 Å²	44.7	38%	0.378	22%	0.217	S	C	.	.	H	α-helix	trans	-56.9	-40.8	178.1	55.9	0	0	0	0	112.4	S161 L165 V166 D167	S161-S163 PolarHBondContact OG-OG 2.87Å; S163-L165 PolarHBondContact O-N 3.18Å; S163-V166 PolarHBondContact O-N 3.45Å; S163-D167 WeakPolarHBondContact O-CB 3.44Å; S163-D167 VanDerWaalsContact O-CG 3.3Å; S163-D167 PolarHBondContact O-N 2.91Å
164	H	97.4	Very high	96.1	Very high	52 Å²	52	47.4 Å²	47.4	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-40.1	175.8	-178	-82	0	0	0	112.3	S161 I162 T168 Y257 R262	S161-H164 PolarHBondContact O-N 2.68Å; S161-H164 PolarHBondContact OG-N 3.24Å; I162-H164 VanDerWaalsContact C-N 3.27Å; I162-H164 PolarHBondContact O-N 3Å; H164-T168 PolarHBondContact CE1-OG1 2.87Å; H164-T168 VanDerWaalsContact O-CB 3.26Å; H164-T168 WeakPolarHBondContact O-CB 3.02Å; H164-T168 PolarHBondContact O-N 3.27Å; H164-T168 PolarHBondContact O-OG1 3.1Å; H164-Y257 AromaticContact CE1-CE2 3.93Å; H164-Y257 AromaticContact ND1-CE2 3.58Å; H164-Y257 AromaticContact ND1-CZ 3.64Å; H164-Y257 PolarHBondContact ND1-OH 2.93Å; H164-R262 PolarHBondContact CE1-O 3.39Å
165	L	97.7	Very high	96	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-64.5	-43.8	175.3	171	56.3	0	0	0	111	F160 S161 I162 S163 T168 I169 V194 L233 I235 Y257	F160-L165 HydrophobicContact CE2-CB 4.1Å; F160-L165 HydrophobicContact CE2-CD2 3.74Å; F160-L165 HydrophobicContact CZ-CD2 3.96Å; S161-L165 PolarHBondContact O-N 3Å; I162-L165 WeakPolarHBondContact O-CA 3.32Å; I162-L165 WeakPolarHBondContact O-CB 3.49Å; I162-L165 PolarHBondContact O-N 3.23Å; S163-L165 PolarHBondContact O-N 3.18Å; L165-T168 WeakPolarHBondContact O-CB 3.46Å; L165-T168 PolarHBondContact O-N 3.45Å; L165-I169 HydrophobicContact CD1-CD1 3.99Å; L165-I169 HydrophobicContact CD1-CG1 4.21Å; L165-I169 HydrophobicContact CG-CD1 4.14Å; L165-I169 WeakPolarHBondContact O-CG1 3.43Å; L165-I169 PolarHBondContact O-N 3.12Å; L165-V194 HydrophobicContact CD2-CG2 3.62Å; L165-V194 HydrophobicContact CG-CG2 4.22Å; L165-L233 HydrophobicContact CD1-CD2 4.07Å; L165-I235 HydrophobicContact CD2-CG1 3.82Å; L165-Y257 HydrophobicContact CB-CD1 4.45Å; L165-Y257 HydrophobicContact CB-CE1 3.94Å; L165-Y257 HydrophobicContact CB-CE2 4.49Å; L165-Y257 HydrophobicContact CD1-CD1 3.74Å; L165-Y257 HydrophobicContact CD1-CD2 3.97Å; L165-Y257 HydrophobicContact CD1-CE1 4.09Å; L165-Y257 HydrophobicContact CD1-CE2 4.31Å; L165-Y257 HydrophobicContact CD1-CG 3.66Å; L165-Y257 HydrophobicContact CD2-CD1 4.35Å; L165-Y257 HydrophobicContact CD2-CE1 4.43Å; L165-Y257 HydrophobicContact CG-CD1 4.41Å; L165-Y257 HydrophobicContact CG-CE1 4.38Å
166	V	97.7	Very high	96	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-49.1	176.5	166.2	0	0	0	0	111.1	I162 S163 T168 I169 R170 V194 E197 L198	I162-V166 HydrophobicContact CG2-CG2 4.15Å; I162-V166 WeakPolarHBondContact O-CG2 3.32Å; I162-V166 PolarHBondContact O-N 3.06Å; S163-V166 PolarHBondContact O-N 3.45Å; V166-T168 VanDerWaalsContact C-N 3.28Å; V166-T168 PolarHBondContact O-N 2.92Å; V166-I169 PolarHBondContact O-N 3.27Å; V166-I169 VanDerWaalsContact O-N 3.12Å; V166-R170 VanDerWaalsContact CG1-NH1 3.25Å; V166-R170 PolarHBondContact O-N 3.22Å; V166-V194 HydrophobicContact CG2-CG1 4.33Å; V166-E197 HydrophobicContact CG1-CB 4.49Å; V166-E197 HydrophobicContact CG2-CB 4.06Å; V166-L198 HydrophobicContact CG1-CD2 3.75Å; V166-L198 HydrophobicContact CG1-CG 4.18Å; V166-L198 HydrophobicContact CG2-CD1 4.36Å; V166-L198 HydrophobicContact CG2-CG 4.29Å
167	D	97.5	Very high	96.2	Very high	90 Å²	90	59.5 Å²	59.5	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-63.5	-35.3	175.8	-68.7	-22.5	0	0	0	112.3	S163 I169 R170 K171	S163-D167 WeakPolarHBondContact O-CB 3.44Å; S163-D167 VanDerWaalsContact O-CG 3.3Å; S163-D167 PolarHBondContact O-N 2.91Å; D167-I169 VanDerWaalsContact C-N 3.34Å; D167-R170 PolarHBondContact O-N 2.77Å; D167-R170 IonicContact OD1-NH1 3.62Å; D167-K171 WeakPolarHBondContact O-CB 3.49Å; D167-K171 PolarHBondContact O-N 2.94Å
168	T	97.4	Very high	96.4	Very high	18 Å²	18	59.3 Å²	59.3	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-64	-41.2	174.2	-61.9	0	0	0	0	110.8	H164 L165 V166 K171 N172 Y257 C264	H164-T168 PolarHBondContact CE1-OG1 2.87Å; H164-T168 VanDerWaalsContact O-CB 3.26Å; H164-T168 WeakPolarHBondContact O-CB 3.02Å; H164-T168 PolarHBondContact O-N 3.27Å; H164-T168 PolarHBondContact O-OG1 3.1Å; L165-T168 WeakPolarHBondContact O-CB 3.46Å; L165-T168 PolarHBondContact O-N 3.45Å; V166-T168 VanDerWaalsContact C-N 3.28Å; V166-T168 PolarHBondContact O-N 2.92Å; T168-K171 PolarHBondContact O-N 2.83Å; T168-N172 PolarHBondContact O-N 3.14Å; T168-N172 PolarHBondContact O-ND2 3.5Å; T168-Y257 HydrophobicContact CG2-CD2 4.16Å; T168-Y257 HydrophobicContact CG2-CE2 4.38Å; T168-C264 HydrophobicContact CG2-CB 3.59Å
169	I	97.8	Very high	96.5	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-49.8	175.7	-69	163.3	0	0	0	110	L165 V166 D167 K171 N172 F173 I179 V194 L198 Y202 L233	L165-I169 HydrophobicContact CD1-CD1 3.99Å; L165-I169 HydrophobicContact CD1-CG1 4.21Å; L165-I169 HydrophobicContact CG-CD1 4.14Å; L165-I169 WeakPolarHBondContact O-CG1 3.43Å; L165-I169 PolarHBondContact O-N 3.12Å; V166-I169 PolarHBondContact O-N 3.27Å; V166-I169 VanDerWaalsContact O-N 3.12Å; D167-I169 VanDerWaalsContact C-N 3.34Å; I169-K171 PolarHBondContact O-N 3.08Å; I169-K171 VanDerWaalsContact O-N 3.15Å; I169-N172 PolarHBondContact O-N 3.43Å; I169-N172 VanDerWaalsContact O-N 3.07Å; I169-F173 HydrophobicContact CB-CD2 4.35Å; I169-F173 HydrophobicContact CG2-CD2 3.93Å; I169-F173 WeakPolarHBondContact O-CD2 3.34Å; I169-F173 PolarHBondContact O-N 2.82Å; I169-I179 HydrophobicContact CG2-CD1 3.8Å; I169-V194 HydrophobicContact CD1-CG1 3.77Å; I169-L198 HydrophobicContact CB-CD1 3.92Å; I169-L198 HydrophobicContact CD1-CD1 3.47Å; I169-L198 VanDerWaalsContact CD1-CD1 3.47Å; I169-L198 HydrophobicContact CG1-CD1 4.29Å; I169-L198 HydrophobicContact CG2-CD1 3.73Å; I169-Y202 HydrophobicContact CG2-CD2 4.32Å; I169-Y202 HydrophobicContact CG2-CE1 4.32Å; I169-Y202 HydrophobicContact CG2-CE2 4.08Å; I169-L233 HydrophobicContact CD1-CD2 3.7Å; I169-L233 HydrophobicContact CG1-CD2 3.58Å
170	R	97.3	Very high	96.8	Very high	100 Å²	100	54.4 Å²	54.4	38%	0.377	27%	0.271	S	S	.	.	H	α-helix	trans	-52.6	-38.1	177	-73.3	-178.1	179.6	128.4	4.7	113.7	V166 D167 L198 E201 Y202	V166-R170 VanDerWaalsContact CG1-NH1 3.25Å; V166-R170 PolarHBondContact O-N 3.22Å; D167-R170 PolarHBondContact O-N 2.77Å; D167-R170 IonicContact OD1-NH1 3.62Å; R170-L198 HydrophobicContact CG-CD2 4.23Å; R170-E201 IonicContact CZ-OE1 3.32Å; R170-E201 IonicContact NE-OE1 3.68Å; R170-E201 PolarHBondContact NE-OE1 3.37Å; R170-E201 IonicContact NE-OE2 3.12Å; R170-E201 PolarHBondContact NE-OE2 3.19Å; R170-E201 IonicContact NH2-OE1 3.58Å; R170-E201 PolarHBondContact NH2-OE1 3.32Å; R170-Y202 VanDerWaalsContact CA-OH 3.29Å; R170-Y202 WeakPolarHBondContact CA-OH 3.2Å; R170-Y202 HydrophobicContact CG-CE2 4.31Å
171	K	96.5	Very high	97	Very high	180 Å²	180	53.1 Å²	53.1	78%	0.783	27%	0.266	S	S	*	.	H	α-helix	trans	-78	-26.1	-178	-172.2	171.1	-178.1	174.3	0	114.2	D167 T168 I169	D167-K171 WeakPolarHBondContact O-CB 3.49Å; D167-K171 PolarHBondContact O-N 2.94Å; T168-K171 PolarHBondContact O-N 2.83Å; I169-K171 PolarHBondContact O-N 3.08Å; I169-K171 VanDerWaalsContact O-N 3.15Å
172	N	96	Very high	97.1	Very high	85 Å²	85	51.4 Å²	51.4	46%	0.455	25%	0.254	S	S	.	.	H	α-helix	trans	-111.4	-16.2	-168.5	-69.8	-80.5	0	0	0	114.3	T168 I169	T168-N172 PolarHBondContact O-N 3.14Å; T168-N172 PolarHBondContact O-ND2 3.5Å; I169-N172 PolarHBondContact O-N 3.43Å; I169-N172 VanDerWaalsContact O-N 3.07Å
173	F	97.1	Very high	97.2	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.079	25%	0.245	C	C	.	.	S	Bend	trans	-123.9	140.2	-178.1	-58	-81.9	0	0	0	111.3	I169 I179 Y202 A231 L233 Y255	I169-F173 HydrophobicContact CB-CD2 4.35Å; I169-F173 HydrophobicContact CG2-CD2 3.93Å; I169-F173 WeakPolarHBondContact O-CD2 3.34Å; I169-F173 PolarHBondContact O-N 2.82Å; F173-I179 HydrophobicContact CB-CD1 3.77Å; F173-I179 HydrophobicContact CD1-CD1 4.17Å; F173-I179 HydrophobicContact CD2-CD1 3.88Å; F173-I179 HydrophobicContact CG-CD1 3.66Å; F173-I179 HydrophobicContact CG-CG1 4.47Å; F173-Y202 HydrophobicContact CB-CE1 3.85Å; F173-Y202 PolarHBondContact O-OH 3Å; F173-A231 HydrophobicContact CD1-CB 3.95Å; F173-A231 HydrophobicContact CE1-CB 3.38Å; F173-A231 HydrophobicContact CZ-CB 4.2Å; F173-L233 HydrophobicContact CE2-CD2 4.48Å; F173-Y255 HydrophobicContact CE1-CD1 4.34Å; F173-Y255 AromaticContact CE1-CD2 3.8Å; F173-Y255 HydrophobicContact CE1-CD2 3.8Å; F173-Y255 HydrophobicContact CE1-CE1 4.09Å; F173-Y255 AromaticContact CE1-CE2 3.55Å; F173-Y255 HydrophobicContact CE1-CE2 3.55Å; F173-Y255 HydrophobicContact CE1-CG 4.21Å; F173-Y255 AromaticContact CE1-CZ 3.71Å; F173-Y255 AromaticContact CZ-CD1 3.9Å; F173-Y255 HydrophobicContact CZ-CD1 3.9Å; F173-Y255 AromaticContact CZ-CD2 3.79Å; F173-Y255 HydrophobicContact CZ-CD2 3.79Å; F173-Y255 HydrophobicContact CZ-CE1 4.05Å; F173-Y255 AromaticContact CZ-CE2 3.98Å; F173-Y255 HydrophobicContact CZ-CE2 3.98Å; F173-Y255 AromaticContact CZ-CG 3.77Å; F173-Y255 HydrophobicContact CZ-CG 3.77Å
174	S	96	Very high	97.3	Very high	83 Å²	83	47.9 Å²	47.9	58%	0.58	23%	0.232	S	C	*	.			trans	-65	146.8	173.9	46.2	0	0	0	0	111.6	S177 Y202	S174-S177 VanDerWaalsContact O-CB 3.27Å; S174-S177 WeakPolarHBondContact O-CB 3.17Å; S174-S177 PolarHBondContact O-N 3.44Å; S174-S177 PolarHBondContact O-OG 3.21Å; S174-S177 PolarHBondContact OG-OG 3.48Å; S174-Y202 WeakPolarHBondContact O-CE1 3.35Å
175	E	94.4	Very high	97.2	Very high	145 Å²	145	45.9 Å²	45.9	68%	0.678	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.2	144.6	170.4	-67.3	179.6	-166	0	0	111.1	S177	E175-S177 PolarHBondContact O-N 2.83Å
176	K	95.2	Very high	97.1	Very high	177 Å²	177	47.6 Å²	47.6	77%	0.77	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.4	0.8	-177.8	-50	177.4	-177.9	175.7	0	115.8	E201	K176-E201 PolarHBondContact N-O 3.34Å
177	S	97.4	Very high	97	Very high	12 Å²	12	47.8 Å²	47.8	8%	0.084	23%	0.232	C	C	.	.			trans	-55.3	141.2	171	-72.9	0	0	0	0	111.5	S174 E175 N203 D230	S174-S177 VanDerWaalsContact O-CB 3.27Å; S174-S177 WeakPolarHBondContact O-CB 3.17Å; S174-S177 PolarHBondContact O-N 3.44Å; S174-S177 PolarHBondContact O-OG 3.21Å; S174-S177 PolarHBondContact OG-OG 3.48Å; E175-S177 PolarHBondContact O-N 2.83Å; S177-N203 PolarHBondContact O-N 2.98Å; S177-D230 VanDerWaalsContact CA-OD2 3.29Å; S177-D230 WeakPolarHBondContact CA-OD2 3.33Å
178	K	97.9	Very high	96.8	Very high	26 Å²	26	44.5 Å²	44.5	11%	0.113	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	104.6	173.9	-170.8	174.5	-175.5	163.9	0	110.2	N203 I205 E228 D230 A231	K178-N203 CarbonylContact C-O 3.59Å; K178-N203 VanDerWaalsContact CA-O 3.31Å; K178-N203 WeakPolarHBondContact CA-O 3.35Å; K178-N203 HydrophobicContact CB-CB 4.25Å; K178-N203 HydrophobicContact CG-CB 4.28Å; K178-I205 HydrophobicContact CG-CG2 4.4Å; K178-E228 HydrophobicContact CD-CG 3.83Å; K178-E228 WeakPolarHBondContact CD-O 3.38Å; K178-E228 IonicContact NZ-OE1 3.33Å; K178-E228 PolarHBondContact NZ-OE1 2.9Å; K178-D230 PolarHBondContact N-OD2 2.82Å; K178-D230 PolarHBondContact O-N 2.76Å; K178-A231 PolarHBondContact O-N 3.05Å
179	I	98.4	Very high	96.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	121	-172.6	-52	174.3	0	0	0	109.2	I169 F173 L181 Y202 N203 I204 I205 A231 L233	I169-I179 HydrophobicContact CG2-CD1 3.8Å; F173-I179 HydrophobicContact CB-CD1 3.77Å; F173-I179 HydrophobicContact CD1-CD1 4.17Å; F173-I179 HydrophobicContact CD2-CD1 3.88Å; F173-I179 HydrophobicContact CG-CD1 3.66Å; F173-I179 HydrophobicContact CG-CG1 4.47Å; I179-L181 HydrophobicContact CG2-CD2 3.99Å; I179-Y202 HydrophobicContact CD1-CD1 3.64Å; I179-Y202 HydrophobicContact CD1-CE1 4.13Å; I179-Y202 HydrophobicContact CD1-CG 4.21Å; I179-N203 PolarHBondContact N-O 2.94Å; I179-I204 HydrophobicContact CB-CD1 3.96Å; I179-I204 HydrophobicContact CD1-CD1 4.35Å; I179-I204 WeakPolarHBondContact O-CA 3.35Å; I179-I205 PolarHBondContact O-N 3.41Å; I179-A231 CarbonylContact C-O 3.6Å; I179-A231 WeakPolarHBondContact CA-O 3.48Å; I179-A231 HydrophobicContact CG2-CB 4.48Å; I179-L233 HydrophobicContact CG2-CB 3.97Å
180	A	98.6	Very high	96.3	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	119.9	170.3	0	0	0	0	0	110.7	I205 L225 T229 A231 L233	A180-I205 CarbonylContact C-O 3.59Å; A180-I205 VanDerWaalsContact CA-CG1 3.49Å; A180-I205 WeakPolarHBondContact CA-O 3.14Å; A180-I205 HydrophobicContact CB-CD1 3.92Å; A180-I205 HydrophobicContact CB-CG1 3.65Å; A180-L225 HydrophobicContact CB-CD1 3.77Å; A180-L225 HydrophobicContact CB-CD2 3.58Å; A180-L225 HydrophobicContact CB-CG 4.32Å; A180-T229 HydrophobicContact CB-CG2 3.89Å; A180-A231 PolarHBondContact N-O 3.13Å; A180-L233 PolarHBondContact O-N 3.1Å
181	L	98.6	Very high	96.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.7	173.7	-56.7	-176.8	0	0	0	109.9	I179 L191 V194 I204 I205 I206 P207 L233 I235	I179-L181 HydrophobicContact CG2-CD2 3.99Å; L181-L191 HydrophobicContact CB-CD2 4.26Å; L181-V194 HydrophobicContact CD1-CB 4.09Å; L181-V194 HydrophobicContact CD1-CG1 3.7Å; L181-I204 HydrophobicContact CD1-CG2 3.47Å; L181-I204 VanDerWaalsContact CD1-CG2 3.47Å; L181-I204 HydrophobicContact CG-CG2 3.78Å; L181-I205 PolarHBondContact N-O 3.07Å; L181-I206 HydrophobicContact CB-CG1 4.31Å; L181-P207 WeakPolarHBondContact O-CD 3.27Å; L181-L233 HydrophobicContact CD2-CB 4.01Å; L181-L233 HydrophobicContact CD2-CD2 3.9Å; L181-L233 HydrophobicContact CD2-CG 4.29Å; L181-I235 HydrophobicContact CD2-CD1 4.39Å
182	M	98.5	Very high	96.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	155.1	178.9	-60.9	179	78.4	0	0	110	P207 G215 T217 A223 L225 L232 L233 F234 I235 A245	M182-P207 HydrophobicContact CE-CG 4.12Å; M182-P207 HydrophobicContact CG-CG 3.63Å; M182-P207 HydrophobicContact SD-CG 3.87Å; M182-G215 CarbonylContact C-O 3.58Å; M182-G215 VanDerWaalsContact CA-O 3.31Å; M182-G215 WeakPolarHBondContact CA-O 3.33Å; M182-T217 WeakPolarHBondContact CE-OG1 3.43Å; M182-A223 HydrophobicContact CE-CB 4.27Å; M182-L225 HydrophobicContact SD-CD2 4.22Å; M182-L232 HydrophobicContact SD-CD1 3.94Å; M182-L232 HydrophobicContact SD-CD2 4.36Å; M182-L232 HydrophobicContact SD-CG 3.97Å; M182-L233 PolarHBondContact N-O 3.09Å; M182-F234 HydrophobicContact CB-CD2 3.94Å; M182-F234 HydrophobicContact CB-CE2 4.36Å; M182-F234 CarbonylContact O-C 3.53Å; M182-F234 VanDerWaalsContact O-CA 3.28Å; M182-F234 WeakPolarHBondContact O-CA 3.41Å; M182-I235 PolarHBondContact O-N 3.18Å; M182-A245 HydrophobicContact CE-CB 4.01Å; M182-A245 HydrophobicContact SD-CB 4.13Å
183	S	98.2	Very high	96.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	172.1	-177.4	-180	0	0	0	0	111.2	F187 G215 E216 T217 I235	S183-F187 VanDerWaalsContact OG-CB 3.28Å; S183-F187 WeakPolarHBondContact OG-CB 3.32Å; S183-G215 PolarHBondContact N-O 3.22Å; S183-G215 VanDerWaalsContact O-O 3.13Å; S183-E216 CarbonylContact O-C 3.54Å; S183-E216 WeakPolarHBondContact O-CA 3.37Å; S183-T217 PolarHBondContact O-N 3.35Å; S183-I235 PolarHBondContact OG-O 3.27Å; S183-I235 VanDerWaalsContact OG-O 3.08Å
184	T	96.9	Very high	96.1	Very high	16 Å²	16	31.9 Å²	31.9	10%	0.098	17%	0.167	C	C	.	.			trans	-76.1	163.3	156.6	61.4	0	0	0	0	111.4	Q186 F187 V188 F234 H241	T184-Q186 PolarHBondContact O-N 2.62Å; T184-Q186 PolarHBondContact OG1-OE1 3.41Å; T184-F187 PolarHBondContact O-N 3.45Å; T184-F187 VanDerWaalsContact O-N 3.15Å; T184-V188 WeakPolarHBondContact O-CG1 3.28Å; T184-F234 HydrophobicContact CG2-CE1 4.41Å; T184-F234 HydrophobicContact CG2-CZ 4.08Å; T184-H241 HydrophobicContact CG2-CB 3.91Å; T184-H241 WeakPolarHBondContact CG2-ND1 3.24Å
185	V	95.8	Very high	96.1	Very high	10 Å²	10	33.2 Å²	33.2	6%	0.061	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-52.2	-31.1	-177.5	72	0	0	0	0	113.7	G136 F155 F187 V188 E216	G136-V185 WeakPolarHBondContact O-CG1 3.44Å; F155-V185 HydrophobicContact CB-CG2 3.91Å; F155-V185 HydrophobicContact CD1-CG2 4.26Å; F155-V185 HydrophobicContact CD2-CG2 3.73Å; F155-V185 HydrophobicContact CE2-CG2 4.3Å; F155-V185 HydrophobicContact CG-CG2 3.71Å; V185-F187 PolarHBondContact O-N 2.89Å; V185-V188 WeakPolarHBondContact O-CG2 3.37Å; V185-V188 PolarHBondContact O-N 3.49Å; V185-E216 HydrophobicContact CB-CG 4.48Å
186	Q	95.8	Very high	96.2	Very high	38 Å²	38	33 Å²	33	18%	0.178	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-67.9	-20.9	-175.2	-56.6	85.3	-1.9	0	0	113.4	G136 V156 D157 I158 T184	G136-Q186 PolarHBondContact O-NE2 3Å; V156-Q186 WeakPolarHBondContact O-CB 3.24Å; D157-Q186 WeakPolarHBondContact CA-O 3.46Å; I158-Q186 HydrophobicContact CD1-CB 3.57Å; I158-Q186 HydrophobicContact CD1-CG 4.06Å; I158-Q186 HydrophobicContact CG1-CB 3.9Å; I158-Q186 PolarHBondContact N-O 2.73Å; T184-Q186 PolarHBondContact O-N 2.62Å; T184-Q186 PolarHBondContact OG1-OE1 3.41Å
187	F	95.9	Very high	96.2	Very high	3 Å²	3	29 Å²	29	1%	0.013	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-116.9	2.7	177.6	-41.5	-88.3	0	0	0	114.5	I158 F160 S183 T184 V185 S189 S190 I235 P259 Y260	I158-F187 HydrophobicContact CB-CD1 3.95Å; I158-F187 HydrophobicContact CB-CE1 3.58Å; I158-F187 HydrophobicContact CB-CZ 4.24Å; I158-F187 HydrophobicContact CD1-CE1 4.08Å; I158-F187 HydrophobicContact CD1-CE2 4.43Å; I158-F187 HydrophobicContact CD1-CZ 3.84Å; I158-F187 HydrophobicContact CG1-CE1 4.42Å; I158-F187 HydrophobicContact CG2-CD1 4.31Å; I158-F187 HydrophobicContact CG2-CE1 3.56Å; I158-F187 HydrophobicContact CG2-CZ 4.25Å; F160-F187 AromaticContact CD1-CD1 3.75Å; F160-F187 HydrophobicContact CD1-CD1 3.75Å; F160-F187 HydrophobicContact CD1-CE1 4.28Å; F160-F187 HydrophobicContact CE1-CB 4.19Å; F160-F187 AromaticContact CE1-CD1 3.79Å; F160-F187 HydrophobicContact CE1-CD1 3.79Å; F160-F187 HydrophobicContact CE1-CG 4.44Å; S183-F187 VanDerWaalsContact OG-CB 3.28Å; S183-F187 WeakPolarHBondContact OG-CB 3.32Å; T184-F187 PolarHBondContact O-N 3.45Å; T184-F187 VanDerWaalsContact O-N 3.15Å; V185-F187 PolarHBondContact O-N 2.89Å; F187-S189 PolarHBondContact O-N 2.97Å; F187-S189 VanDerWaalsContact O-N 3.17Å; F187-S190 WeakPolarHBondContact O-CB 3.27Å; F187-S190 PolarHBondContact O-N 3.09Å; F187-S190 PolarHBondContact O-OG 2.98Å; F187-I235 HydrophobicContact CB-CG2 4.01Å; F187-I235 HydrophobicContact CD1-CG2 4.49Å; F187-I235 HydrophobicContact CD2-CG2 4.44Å; F187-I235 HydrophobicContact CG-CG2 4.09Å; F187-P259 HydrophobicContact CD1-CG 4.17Å; F187-P259 HydrophobicContact CE1-CB 4.2Å; F187-P259 HydrophobicContact CE1-CG 3.76Å; F187-P259 HydrophobicContact CZ-CG 4.07Å; F187-Y260 HydrophobicContact CZ-CE2 4.4Å
188	V	93.4	Very high	96.2	Very high	22 Å²	22	28.5 Å²	28.5	13%	0.133	14%	0.138	C	C	.	.	H	α-helix	trans	-61.6	-29.5	-174.8	-61.9	0	0	0	0	113.7	T184 V185 S190 L191 E216	T184-V188 WeakPolarHBondContact O-CG1 3.28Å; V185-V188 WeakPolarHBondContact O-CG2 3.37Å; V185-V188 PolarHBondContact O-N 3.49Å; V188-S190 PolarHBondContact O-N 2.97Å; V188-L191 PolarHBondContact O-N 3.25Å; V188-E216 HydrophobicContact CG1-CB 3.98Å; V188-E216 HydrophobicContact CG1-CG 4.5Å
189	S	89.8	Confident	96	Very high	41 Å²	41	33 Å²	33	29%	0.287	16%	0.159	S	C	.	.	H	α-helix	trans	-61	-34.9	176.9	58.8	0	0	0	0	112.2	D157 F187	D157-S189 WeakPolarHBondContact OD1-CB 3.38Å; D157-S189 PolarHBondContact OD1-OG 3Å; D157-S189 PolarHBondContact OD2-OG 3.24Å; F187-S189 PolarHBondContact O-N 2.97Å; F187-S189 VanDerWaalsContact O-N 3.17Å
190	S	94.1	Very high	95.8	Very high	8 Å²	8	41.2 Å²	41.2	6%	0.056	20%	0.198	C	C	.	.	H	α-helix	trans	-72	-26.8	179.7	74.1	0	0	0	0	113.4	F160 F187 V188 Q192 A193 V194	F160-S190 VanDerWaalsContact CE1-CB 3.49Å; F160-S190 VanDerWaalsContact CE1-OG 3.24Å; F160-S190 WeakPolarHBondContact CE1-OG 3.31Å; F160-S190 VanDerWaalsContact CZ-OG 3.26Å; F160-S190 WeakPolarHBondContact CZ-OG 3.42Å; F187-S190 WeakPolarHBondContact O-CB 3.27Å; F187-S190 PolarHBondContact O-N 3.09Å; F187-S190 PolarHBondContact O-OG 2.98Å; V188-S190 PolarHBondContact O-N 2.97Å; S190-Q192 VanDerWaalsContact C-N 3.29Å; S190-Q192 PolarHBondContact O-N 3.16Å; S190-A193 WeakPolarHBondContact O-CB 3.42Å; S190-A193 PolarHBondContact O-N 3.12Å; S190-A193 VanDerWaalsContact O-N 3.09Å; S190-V194 WeakPolarHBondContact O-CG2 3.44Å; S190-V194 PolarHBondContact O-N 2.99Å
191	L	96.8	Very high	95.7	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-37	-174.6	-54.8	-175.2	0	0	0	111.8	L181 V188 V194 R195 I206 I235	L181-L191 HydrophobicContact CB-CD2 4.26Å; V188-L191 PolarHBondContact O-N 3.25Å; L191-V194 PolarHBondContact O-N 3.03Å; L191-R195 WeakPolarHBondContact O-CB 3.35Å; L191-R195 PolarHBondContact O-N 3.19Å; L191-I206 HydrophobicContact CB-CD1 3.97Å; L191-I235 HydrophobicContact CD2-CB 4.39Å; L191-I235 HydrophobicContact CD2-CD1 3.61Å; L191-I235 HydrophobicContact CD2-CG1 4Å
192	Q	94.6	Very high	95.6	Very high	77 Å²	77	44.6 Å²	44.6	36%	0.36	21%	0.213	S	C	.	.	H	α-helix	trans	-68.9	-35.5	177	-64	-60.8	-25.1	0	0	112.2	S190 R195 Q196 I206	S190-Q192 VanDerWaalsContact C-N 3.29Å; S190-Q192 PolarHBondContact O-N 3.16Å; Q192-R195 PolarHBondContact O-N 2.93Å; Q192-Q196 WeakPolarHBondContact O-CG 3.45Å; Q192-Q196 PolarHBondContact O-N 3.4Å; Q192-I206 HydrophobicContact CG-CD1 4.41Å; Q192-I206 VanDerWaalsContact NE2-CD1 3.29Å
193	A	95	Very high	95.6	Very high	10 Å²	10	48.5 Å²	48.5	8%	0.083	23%	0.234	C	C	.	.	H	α-helix	trans	-67.2	-45.7	175.3	0	0	0	0	0	111	I162 S190 R195 Q196 E197	I162-A193 HydrophobicContact CD1-CB 3.83Å; S190-A193 WeakPolarHBondContact O-CB 3.42Å; S190-A193 PolarHBondContact O-N 3.12Å; S190-A193 VanDerWaalsContact O-N 3.09Å; A193-R195 VanDerWaalsContact C-N 3.31Å; A193-R195 PolarHBondContact O-N 2.84Å; A193-Q196 PolarHBondContact O-N 3.05Å; A193-Q196 VanDerWaalsContact O-N 3.11Å; A193-E197 PolarHBondContact O-N 3.4Å
194	V	96.9	Very high	95.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-44.5	173.9	176.5	0	0	0	0	111.1	I162 L165 V166 I169 L181 S190 L191 Q196 E197 L198	I162-V194 HydrophobicContact CG2-CG2 3.94Å; L165-V194 HydrophobicContact CD2-CG2 3.62Å; L165-V194 HydrophobicContact CG-CG2 4.22Å; V166-V194 HydrophobicContact CG2-CG1 4.33Å; I169-V194 HydrophobicContact CD1-CG1 3.77Å; L181-V194 HydrophobicContact CD1-CB 4.09Å; L181-V194 HydrophobicContact CD1-CG1 3.7Å; S190-V194 WeakPolarHBondContact O-CG2 3.44Å; S190-V194 PolarHBondContact O-N 2.99Å; L191-V194 PolarHBondContact O-N 3.03Å; V194-Q196 VanDerWaalsContact C-N 3.33Å; V194-Q196 PolarHBondContact O-N 3.39Å; V194-E197 PolarHBondContact O-N 2.87Å; V194-L198 HydrophobicContact CG1-CD1 3.8Å; V194-L198 WeakPolarHBondContact O-CB 3.26Å; V194-L198 PolarHBondContact O-N 2.87Å; V194-L198 VanDerWaalsContact O-N 3.11Å
195	R	96.6	Very high	95.6	Very high	112 Å²	112	49.4 Å²	49.4	42%	0.423	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-43.8	175.6	176.4	174.4	-176.7	-174.6	3.4	112	L191 Q192 A193 L198 H199 I204 I206	L191-R195 WeakPolarHBondContact O-CB 3.35Å; L191-R195 PolarHBondContact O-N 3.19Å; Q192-R195 PolarHBondContact O-N 2.93Å; A193-R195 VanDerWaalsContact C-N 3.31Å; A193-R195 PolarHBondContact O-N 2.84Å; R195-L198 PolarHBondContact O-N 3.2Å; R195-H199 WeakPolarHBondContact O-CB 3.36Å; R195-H199 PolarHBondContact O-N 2.89Å; R195-I204 HydrophobicContact CB-CB 4.36Å; R195-I204 HydrophobicContact CB-CG2 3.76Å; R195-I204 HydrophobicContact CG-CB 4.03Å; R195-I204 HydrophobicContact CG-CG2 3.85Å; R195-I206 HydrophobicContact CB-CD1 3.99Å
196	Q	95.7	Very high	95.7	Very high	141 Å²	141	50 Å²	50	66%	0.659	24%	0.241	S	C	*	.	H	α-helix	trans	-64.5	-41.3	179.1	-75.1	173.5	9.9	0	0	112	Q192 A193 V194 L198 H199	Q192-Q196 WeakPolarHBondContact O-CG 3.45Å; Q192-Q196 PolarHBondContact O-N 3.4Å; A193-Q196 PolarHBondContact O-N 3.05Å; A193-Q196 VanDerWaalsContact O-N 3.11Å; V194-Q196 VanDerWaalsContact C-N 3.33Å; V194-Q196 PolarHBondContact O-N 3.39Å; Q196-L198 VanDerWaalsContact C-N 3.31Å; Q196-L198 PolarHBondContact O-N 3.4Å; Q196-H199 PolarHBondContact O-ND1 3.43Å
197	E	96.2	Very high	95.8	Very high	93 Å²	93	49 Å²	49	44%	0.435	24%	0.237	S	C	.	.	H	α-helix	trans	-69	-27.2	178.8	-71.9	-171.9	-143.7	0	0	113.6	V166 A193 V194	V166-E197 HydrophobicContact CG1-CB 4.49Å; V166-E197 HydrophobicContact CG2-CB 4.06Å; A193-E197 PolarHBondContact O-N 3.4Å; V194-E197 PolarHBondContact O-N 2.87Å
198	L	96.8	Very high	95.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-109.1	0.1	-172.7	-69.3	177.6	0	0	0	115	V166 I169 R170 V194 R195 Q196 E200 E201 Y202 I204	V166-L198 HydrophobicContact CG1-CD2 3.75Å; V166-L198 HydrophobicContact CG1-CG 4.18Å; V166-L198 HydrophobicContact CG2-CD1 4.36Å; V166-L198 HydrophobicContact CG2-CG 4.29Å; I169-L198 HydrophobicContact CB-CD1 3.92Å; I169-L198 HydrophobicContact CD1-CD1 3.47Å; I169-L198 VanDerWaalsContact CD1-CD1 3.47Å; I169-L198 HydrophobicContact CG1-CD1 4.29Å; I169-L198 HydrophobicContact CG2-CD1 3.73Å; R170-L198 HydrophobicContact CG-CD2 4.23Å; V194-L198 HydrophobicContact CG1-CD1 3.8Å; V194-L198 WeakPolarHBondContact O-CB 3.26Å; V194-L198 PolarHBondContact O-N 2.87Å; V194-L198 VanDerWaalsContact O-N 3.11Å; R195-L198 PolarHBondContact O-N 3.2Å; Q196-L198 VanDerWaalsContact C-N 3.31Å; Q196-L198 PolarHBondContact O-N 3.4Å; L198-E200 PolarHBondContact O-N 3.46Å; L198-E200 VanDerWaalsContact O-N 3.16Å; L198-E201 PolarHBondContact O-N 3.06Å; L198-E201 VanDerWaalsContact O-N 3.11Å; L198-Y202 HydrophobicContact CB-CD2 4.05Å; L198-Y202 HydrophobicContact CD1-CD2 4.46Å; L198-Y202 HydrophobicContact CD2-CD2 3.87Å; L198-Y202 HydrophobicContact CD2-CE2 3.91Å; L198-Y202 HydrophobicContact CG-CD2 4.36Å; L198-Y202 PolarHBondContact O-N 3.05Å; L198-I204 HydrophobicContact CB-CD1 4.43Å; L198-I204 HydrophobicContact CB-CG1 4.1Å
199	H	93	Very high	96	Very high	120 Å²	120	52.6 Å²	52.6	56%	0.556	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-24	-169.5	75.7	-73.2	0	0	0	115.2	R195 Q196	R195-H199 WeakPolarHBondContact O-CB 3.36Å; R195-H199 PolarHBondContact O-N 2.89Å; Q196-H199 PolarHBondContact O-ND1 3.43Å
200	E	94.2	Very high	96.2	Very high	173 Å²	173	56.1 Å²	56.1	81%	0.808	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-28.2	177.7	-59.9	-172.2	165.1	0	0	112.3	L198	L198-E200 PolarHBondContact O-N 3.46Å; L198-E200 VanDerWaalsContact O-N 3.16Å
201	E	96.5	Very high	96.1	Very high	59 Å²	59	58.5 Å²	58.5	28%	0.276	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-30.2	-174	-64.5	172	-105.5	0	0	112.2	R170 K176 L198	R170-E201 IonicContact CZ-OE1 3.32Å; R170-E201 IonicContact NE-OE1 3.68Å; R170-E201 PolarHBondContact NE-OE1 3.37Å; R170-E201 IonicContact NE-OE2 3.12Å; R170-E201 PolarHBondContact NE-OE2 3.19Å; R170-E201 IonicContact NH2-OE1 3.58Å; R170-E201 PolarHBondContact NH2-OE1 3.32Å; K176-E201 PolarHBondContact N-O 3.34Å; L198-E201 PolarHBondContact O-N 3.06Å; L198-E201 VanDerWaalsContact O-N 3.11Å
202	Y	97.6	Very high	96	Very high	13 Å²	13	58.7 Å²	58.7	5%	0.051	28%	0.28	C	S	.	.	S	Bend	trans	-136.9	153.2	-170.9	-61.4	-85.3	0	0	0	113	I169 R170 F173 S174 I179 L198 I204	I169-Y202 HydrophobicContact CG2-CD2 4.32Å; I169-Y202 HydrophobicContact CG2-CE1 4.32Å; I169-Y202 HydrophobicContact CG2-CE2 4.08Å; R170-Y202 VanDerWaalsContact CA-OH 3.29Å; R170-Y202 WeakPolarHBondContact CA-OH 3.2Å; R170-Y202 HydrophobicContact CG-CE2 4.31Å; F173-Y202 HydrophobicContact CB-CE1 3.85Å; F173-Y202 PolarHBondContact O-OH 3Å; S174-Y202 WeakPolarHBondContact O-CE1 3.35Å; I179-Y202 HydrophobicContact CD1-CD1 3.64Å; I179-Y202 HydrophobicContact CD1-CE1 4.13Å; I179-Y202 HydrophobicContact CD1-CG 4.21Å; L198-Y202 HydrophobicContact CB-CD2 4.05Å; L198-Y202 HydrophobicContact CD1-CD2 4.46Å; L198-Y202 HydrophobicContact CD2-CD2 3.87Å; L198-Y202 HydrophobicContact CD2-CE2 3.91Å; L198-Y202 HydrophobicContact CG-CD2 4.36Å; L198-Y202 PolarHBondContact O-N 3.05Å; Y202-I204 HydrophobicContact CG-CD1 4.44Å; Y202-I204 PolarHBondContact O-N 3.24Å
203	N	97.3	Very high	96	Very high	83 Å²	83	56.8 Å²	56.8	44%	0.444	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	82.2	169	-175.2	0.2	0	0	0	110.1	S177 K178 I179 I205	S177-N203 PolarHBondContact O-N 2.98Å; K178-N203 CarbonylContact C-O 3.59Å; K178-N203 VanDerWaalsContact CA-O 3.31Å; K178-N203 WeakPolarHBondContact CA-O 3.35Å; K178-N203 HydrophobicContact CB-CB 4.25Å; K178-N203 HydrophobicContact CG-CB 4.28Å; I179-N203 PolarHBondContact N-O 2.94Å; N203-I205 PolarHBondContact O-N 2.81Å
204	I	97.8	Very high	96.1	Very high	6 Å²	6	58.9 Å²	58.9	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	119	-179.2	-57.4	-56.5	0	0	0	111.1	I179 L181 R195 L198 Y202 I206	I179-I204 HydrophobicContact CB-CD1 3.96Å; I179-I204 HydrophobicContact CD1-CD1 4.35Å; I179-I204 WeakPolarHBondContact O-CA 3.35Å; L181-I204 HydrophobicContact CD1-CG2 3.47Å; L181-I204 VanDerWaalsContact CD1-CG2 3.47Å; L181-I204 HydrophobicContact CG-CG2 3.78Å; R195-I204 HydrophobicContact CB-CB 4.36Å; R195-I204 HydrophobicContact CB-CG2 3.76Å; R195-I204 HydrophobicContact CG-CB 4.03Å; R195-I204 HydrophobicContact CG-CG2 3.85Å; L198-I204 HydrophobicContact CB-CD1 4.43Å; L198-I204 HydrophobicContact CB-CG1 4.1Å; Y202-I204 HydrophobicContact CG-CD1 4.44Å; Y202-I204 PolarHBondContact O-N 3.24Å; I204-I206 HydrophobicContact CG2-CG1 4.47Å
205	I	97.4	Very high	96.1	Very high	29 Å²	29	58.9 Å²	58.9	15%	0.149	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.2	170.5	69.4	175.3	0	0	0	110.8	K178 I179 A180 L181 N203 L225 P226 T229	K178-I205 HydrophobicContact CG-CG2 4.4Å; I179-I205 PolarHBondContact O-N 3.41Å; A180-I205 CarbonylContact C-O 3.59Å; A180-I205 VanDerWaalsContact CA-CG1 3.49Å; A180-I205 WeakPolarHBondContact CA-O 3.14Å; A180-I205 HydrophobicContact CB-CD1 3.92Å; A180-I205 HydrophobicContact CB-CG1 3.65Å; L181-I205 PolarHBondContact N-O 3.07Å; N203-I205 PolarHBondContact O-N 2.81Å; I205-L225 HydrophobicContact CD1-CD2 4.33Å; I205-P226 HydrophobicContact CD1-CG 4.2Å; I205-T229 HydrophobicContact CD1-CG2 4.21Å
206	I	98.1	Very high	96.2	Very high	22 Å²	22	53.7 Å²	53.7	11%	0.113	27%	0.269	C	S	.	.			trans	-120	92.4	173.9	-62.6	174.1	0	0	0	105.6	L181 L191 Q192 R195 I204 P214 G215	L181-I206 HydrophobicContact CB-CG1 4.31Å; L191-I206 HydrophobicContact CB-CD1 3.97Å; Q192-I206 HydrophobicContact CG-CD1 4.41Å; Q192-I206 VanDerWaalsContact NE2-CD1 3.29Å; R195-I206 HydrophobicContact CB-CD1 3.99Å; I204-I206 HydrophobicContact CG2-CG1 4.47Å; I206-P214 VanDerWaalsContact CG2-C 3.4Å; I206-P214 HydrophobicContact CG2-CB 3.76Å; I206-G215 VanDerWaalsContact CG2-N 3.29Å
207	P	97.7	Very high	96.3	Very high	17 Å²	17	47 Å²	47	11%	0.11	24%	0.238	C	C	.	.			trans	-70.9	159.5	-172.7	34.8	-40.1	0	0	0	110.7	L181 M182 G215 A223 L225	L181-P207 WeakPolarHBondContact O-CD 3.27Å; M182-P207 HydrophobicContact CE-CG 4.12Å; M182-P207 HydrophobicContact CG-CG 3.63Å; M182-P207 HydrophobicContact SD-CG 3.87Å; P207-G215 WeakPolarHBondContact O-CA 3.26Å; P207-G215 PolarHBondContact O-N 2.98Å; P207-A223 HydrophobicContact CB-CB 3.76Å; P207-A223 HydrophobicContact CG-CB 4.22Å; P207-L225 HydrophobicContact CB-CD2 3.79Å; P207-L225 HydrophobicContact CG-CD2 3.67Å
208	Q	97.2	Very high	96.3	Very high	91 Å²	91	43.8 Å²	43.8	43%	0.425	22%	0.223	S	C	.	.			trans	-140.3	127	-179.7	-171.9	-177.6	22.4	0	0	110.7	K210 L212 P214	Q208-K210 HydrophobicContact CG-CG 4.42Å; Q208-L212 VanDerWaalsContact CG-O 3.31Å; Q208-L212 WeakPolarHBondContact CG-O 3.39Å; Q208-L212 PolarHBondContact NE2-O 3.43Å; Q208-P214 HydrophobicContact CG-CG 4.45Å
209	S	95.9	Very high	96.3	Very high	10 Å²	10	44 Å²	44	7%	0.07	23%	0.226	C	C	.	.			trans	-104.5	105.9	164.7	-179.2	0	0	0	0	108.2	L212 T221	S209-L212 WeakPolarHBondContact O-CB 2.98Å; S209-L212 WeakPolarHBondContact O-CG 3.41Å; S209-L212 PolarHBondContact O-N 3.19Å; S209-T221 VanDerWaalsContact OG-CG2 3.26Å; S209-T221 WeakPolarHBondContact OG-CG2 3.5Å
210	K	94.7	Very high	96.5	Very high	114 Å²	114	39 Å²	39	50%	0.496	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	140.2	-177.9	-66.5	-179.3	179.6	172.1	0	109.8	Q208 A388 N389	Q208-K210 HydrophobicContact CG-CG 4.42Å; K210-A388 CarbonylContact O-C 3.54Å; K210-A388 WeakPolarHBondContact O-CA 3.31Å; K210-N389 HydrophobicContact CB-CB 4.29Å; K210-N389 VanDerWaalsContact CB-ND2 3.35Å; K210-N389 WeakPolarHBondContact CB-ND2 3.48Å; K210-N389 PolarHBondContact O-N 3.34Å
211	P	93	Very high	96.7	Very high	59 Å²	59	30.8 Å²	30.8	38%	0.383	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.9	5.4	14.7	36.5	-37.1	0	0	0	115.5	Y387	P211-Y387 WeakPolarHBondContact CD-O 3.26Å
212	L	94.5	Very high	96.7	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.016	16%	0.156	C	C	.	.	S	Bend	trans	-64.8	159.2	-176.1	-49.6	-179.7	0	0	0	112.2	L140 Q208 S209 E216 L218 T221	L140-L212 HydrophobicContact CD1-CD2 3.91Å; Q208-L212 VanDerWaalsContact CG-O 3.31Å; Q208-L212 WeakPolarHBondContact CG-O 3.39Å; Q208-L212 PolarHBondContact NE2-O 3.43Å; S209-L212 WeakPolarHBondContact O-CB 2.98Å; S209-L212 WeakPolarHBondContact O-CG 3.41Å; S209-L212 PolarHBondContact O-N 3.19Å; L212-E216 HydrophobicContact CB-CB 4.06Å; L212-E216 HydrophobicContact CB-CG 4.27Å; L212-L218 HydrophobicContact CD1-CB 4.42Å; L212-L218 HydrophobicContact CD1-CD1 4.18Å; L212-L218 HydrophobicContact CD1-CG 3.78Å; L212-L218 HydrophobicContact CD2-CD1 3.53Å; L212-L218 HydrophobicContact CD2-CG 3.86Å; L212-L218 HydrophobicContact CG-CD1 4.49Å; L212-L218 HydrophobicContact CG-CG 4.49Å; L212-T221 HydrophobicContact CD1-CG2 3.88Å
213	S	94.5	Very high	96.7	Very high	38 Å²	38	28 Å²	28	27%	0.266	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-67	155.1	175.3	-52.5	0	0	0	0	111.1	G215 E216	S213-G215 PolarHBondContact O-N 3.11Å; S213-E216 WeakPolarHBondContact CB-OE2 3.46Å; S213-E216 PolarHBondContact N-OE2 3.18Å; S213-E216 WeakPolarHBondContact O-CB 3.48Å; S213-E216 PolarHBondContact O-N 2.89Å; S213-E216 PolarHBondContact OG-OE2 2.53Å
214	P	96.8	Very high	96.7	Very high	54 Å²	54	30.5 Å²	30.5	35%	0.351	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	127.3	173	-24.7	34.7	0	0	0	111.7	I206 Q208 E216	I206-P214 VanDerWaalsContact CG2-C 3.4Å; I206-P214 HydrophobicContact CG2-CB 3.76Å; Q208-P214 HydrophobicContact CG-CG 4.45Å; P214-E216 VanDerWaalsContact C-N 3.25Å; P214-E216 PolarHBondContact O-N 3.46Å
215	G	97.6	Very high	96.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	-9.7	-178.3	0	0	0	0	0	114.2	M182 S183 I206 P207 S213	M182-G215 CarbonylContact C-O 3.58Å; M182-G215 VanDerWaalsContact CA-O 3.31Å; M182-G215 WeakPolarHBondContact CA-O 3.33Å; S183-G215 PolarHBondContact N-O 3.22Å; S183-G215 VanDerWaalsContact O-O 3.13Å; I206-G215 VanDerWaalsContact CG2-N 3.29Å; P207-G215 WeakPolarHBondContact O-CA 3.26Å; P207-G215 PolarHBondContact O-N 2.98Å; S213-G215 PolarHBondContact O-N 3.11Å
216	E	97.7	Very high	96.7	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.014	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-74.7	130.9	-180	-171.8	178.3	-175.4	0	0	111.5	S138 S183 V185 V188 L212 S213 P214	S138-E216 VanDerWaalsContact CB-OE1 3.26Å; S138-E216 WeakPolarHBondContact CB-OE1 3.46Å; S138-E216 PolarHBondContact OG-OE1 2.92Å; S183-E216 CarbonylContact O-C 3.54Å; S183-E216 WeakPolarHBondContact O-CA 3.37Å; V185-E216 HydrophobicContact CB-CG 4.48Å; V188-E216 HydrophobicContact CG1-CB 3.98Å; V188-E216 HydrophobicContact CG1-CG 4.5Å; L212-E216 HydrophobicContact CB-CB 4.06Å; L212-E216 HydrophobicContact CB-CG 4.27Å; S213-E216 WeakPolarHBondContact CB-OE2 3.46Å; S213-E216 PolarHBondContact N-OE2 3.18Å; S213-E216 WeakPolarHBondContact O-CB 3.48Å; S213-E216 PolarHBondContact O-N 2.89Å; S213-E216 PolarHBondContact OG-OE2 2.53Å; P214-E216 VanDerWaalsContact C-N 3.25Å; P214-E216 PolarHBondContact O-N 3.46Å
217	T	97.7	Very high	96.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.204	C	C	.	.			trans	-122.6	130	175	-52.2	0	0	0	0	110.1	M182 S183 A222 F234 H241 A244 A245	M182-T217 WeakPolarHBondContact CE-OG1 3.43Å; S183-T217 PolarHBondContact O-N 3.35Å; T217-A222 HydrophobicContact CG2-CB 3.85Å; T217-F234 HydrophobicContact CG2-CE2 4.32Å; T217-H241 VanDerWaalsContact CG2-O 3.31Å; T217-H241 WeakPolarHBondContact CG2-O 3.43Å; T217-H241 PolarHBondContact O-CD2 2.91Å; T217-A244 HydrophobicContact CG2-CB 4.37Å; T217-A245 HydrophobicContact CG2-CB 4.25Å
218	L	97.3	Very high	96.4	Very high	26 Å²	26	40.9 Å²	40.9	14%	0.136	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-102	160	168.9	-60.3	-174.5	0	0	0	110.3	L140 L212 C220 T221 A244	L140-L218 HydrophobicContact CD1-CD1 3.75Å; L140-L218 HydrophobicContact CD2-CD1 3.78Å; L140-L218 HydrophobicContact CG-CD1 4.37Å; L212-L218 HydrophobicContact CD1-CB 4.42Å; L212-L218 HydrophobicContact CD1-CD1 4.18Å; L212-L218 HydrophobicContact CD1-CG 3.78Å; L212-L218 HydrophobicContact CD2-CD1 3.53Å; L212-L218 HydrophobicContact CD2-CG 3.86Å; L212-L218 HydrophobicContact CG-CD1 4.49Å; L212-L218 HydrophobicContact CG-CG 4.49Å; L218-C220 PolarHBondContact O-N 2.81Å; L218-C220 VanDerWaalsContact O-N 3.14Å; L218-T221 PolarHBondContact N-O 3.47Å; L218-T221 PolarHBondContact O-N 2.79Å; L218-T221 VanDerWaalsContact O-O 3.1Å; L218-A244 WeakPolarHBondContact O-CB 3.35Å
219	G	96.8	Very high	96.4	Very high	5 Å²	5	37 Å²	37	5%	0.052	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.8	173.9	0	0	0	0	0	114	F240 H241 R350 M384	G219-F240 VanDerWaalsContact CA-CE1 3.44Å; G219-H241 PolarHBondContact N-CD2 2.7Å; G219-H241 VanDerWaalsContact N-CD2 3.3Å; G219-R350 VanDerWaalsContact O-CD 3.29Å; G219-R350 WeakPolarHBondContact O-CD 3.49Å; G219-R350 VanDerWaalsContact O-CG 3.29Å; G219-R350 WeakPolarHBondContact O-CG 3.38Å; G219-M384 WeakPolarHBondContact O-CE 3.46Å
220	C	96.6	Very high	96.5	Very high	15 Å²	15	40.8 Å²	40.8	10%	0.101	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-3.6	-178.3	58.3	0	0	0	0	113.6	L218 P349 Y386	L218-C220 PolarHBondContact O-N 2.81Å; L218-C220 VanDerWaalsContact O-N 3.14Å; C220-P349 HydrophobicContact CB-CG 3.92Å; C220-Y386 HydrophobicContact CB-CD1 4.36Å; C220-Y386 WeakPolarHBondContact O-CB 3.17Å; C220-Y386 PolarHBondContact O-N 2.81Å
221	T	97.5	Very high	96.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-150.6	116.4	-178.5	-61.9	0	0	0	0	110.6	S209 L212 L218 M384 Y387 A388	S209-T221 VanDerWaalsContact OG-CG2 3.26Å; S209-T221 WeakPolarHBondContact OG-CG2 3.5Å; L212-T221 HydrophobicContact CD1-CG2 3.88Å; L218-T221 PolarHBondContact N-O 3.47Å; L218-T221 PolarHBondContact O-N 2.79Å; L218-T221 VanDerWaalsContact O-O 3.1Å; T221-M384 CarbonylContact C-O 3.32Å; T221-M384 WeakPolarHBondContact CA-O 2.93Å; T221-Y387 PolarHBondContact OG1-N 2.89Å; T221-A388 HydrophobicContact CG2-CB 4.14Å
222	A	97.9	Very high	96.9	Very high	8 Å²	8	32.7 Å²	32.7	7%	0.066	18%	0.184	C	C	.	.			trans	-135.5	139.5	-178.6	0	0	0	0	0	110.8	T217 A244 A248 M384	T217-A222 HydrophobicContact CG2-CB 3.85Å; A222-A244 HydrophobicContact CB-CB 4.28Å; A222-A244 WeakPolarHBondContact CB-O 3.45Å; A222-A248 HydrophobicContact CB-CB 4.01Å; A222-M384 HydrophobicContact CB-CB 4.12Å; A222-M384 PolarHBondContact N-O 3.41Å
223	A	97.7	Very high	97.1	Very high	6 Å²	6	32.7 Å²	32.7	5%	0.05	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-72.2	140.5	179.8	0	0	0	0	0	111.7	M182 P207 N249	M182-A223 HydrophobicContact CE-CB 4.27Å; P207-A223 HydrophobicContact CB-CB 3.76Å; P207-A223 HydrophobicContact CG-CB 4.22Å; A223-N249 PolarHBondContact O-ND2 3.34Å
224	K	97.1	Very high	97.3	Very high	134 Å²	134	31 Å²	31	58%	0.583	17%	0.172	S	C	*	.	P	Polyproline II helix	trans	-77.6	136.9	168.6	-66.1	-178	180	179.1	0	109.6	N249	K224-N249 WeakPolarHBondContact CA-OD1 3.48Å
225	L	97.6	Very high	97.4	Very high	19 Å²	19	28.4 Å²	28.4	10%	0.099	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-94.5	149.7	-179.4	-60.6	179.3	0	0	0	110.5	A180 M182 I205 P207 T229 L232 N249 V252	A180-L225 HydrophobicContact CB-CD1 3.77Å; A180-L225 HydrophobicContact CB-CD2 3.58Å; A180-L225 HydrophobicContact CB-CG 4.32Å; M182-L225 HydrophobicContact SD-CD2 4.22Å; I205-L225 HydrophobicContact CD1-CD2 4.33Å; P207-L225 HydrophobicContact CB-CD2 3.79Å; P207-L225 HydrophobicContact CG-CD2 3.67Å; L225-T229 HydrophobicContact CD1-CG2 4.22Å; L225-L232 HydrophobicContact CD1-CB 4.03Å; L225-L232 HydrophobicContact CD1-CD1 3.78Å; L225-L232 HydrophobicContact CD1-CG 4.01Å; L225-N249 WeakPolarHBondContact CB-OD1 3.36Å; L225-N249 HydrophobicContact CD1-CB 4.22Å; L225-N249 HydrophobicContact CG-CB 4.44Å; L225-N249 WeakPolarHBondContact CG-OD1 3.4Å; L225-N249 PolarHBondContact N-OD1 3.3Å; L225-V252 HydrophobicContact CD1-CB 4.45Å; L225-V252 HydrophobicContact CD1-CG1 4.22Å; L225-V252 HydrophobicContact CD1-CG2 4.23Å
226	P	96.2	Very high	97.4	Very high	43 Å²	43	28.4 Å²	28.4	28%	0.279	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-58.1	141.5	169.6	-22.4	33.1	0	0	0	111.4	I205 E228 T229	I205-P226 HydrophobicContact CD1-CG 4.2Å; P226-E228 HydrophobicContact CB-CG 4.49Å; P226-E228 WeakPolarHBondContact CB-OE1 3.49Å; P226-E228 WeakPolarHBondContact CB-OE2 3.24Å; P226-E228 PolarHBondContact O-N 3.49Å; P226-E228 VanDerWaalsContact O-N 3.07Å; P226-T229 WeakPolarHBondContact O-CB 3.47Å; P226-T229 PolarHBondContact O-N 2.93Å; P226-T229 PolarHBondContact O-OG1 2.95Å
227	P	93.9	Very high	97.2	Very high	121 Å²	121	32.5 Å²	32.5	79%	0.786	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-28	-178.4	-27.5	35.2	0	0	0	115.1	T229	P227-T229 PolarHBondContact O-N 3.14Å
228	E	95.3	Very high	97	Very high	109 Å²	109	34.1 Å²	34.1	51%	0.509	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	11.8	-179.9	72.3	-76.2	-179.4	0	0	114.3	K178 P226	K178-E228 HydrophobicContact CD-CG 3.83Å; K178-E228 WeakPolarHBondContact CD-O 3.38Å; K178-E228 IonicContact NZ-OE1 3.33Å; K178-E228 PolarHBondContact NZ-OE1 2.9Å; P226-E228 HydrophobicContact CB-CG 4.49Å; P226-E228 WeakPolarHBondContact CB-OE1 3.49Å; P226-E228 WeakPolarHBondContact CB-OE2 3.24Å; P226-E228 PolarHBondContact O-N 3.49Å; P226-E228 VanDerWaalsContact O-N 3.07Å
229	T	98.1	Very high	96.9	Very high	9 Å²	9	37.3 Å²	37.3	6%	0.055	21%	0.205	C	C	.	.			trans	-78.1	119.9	177.2	-53.5	0	0	0	0	110.4	A180 I205 L225 P226 P227 A231 V252	A180-T229 HydrophobicContact CB-CG2 3.89Å; I205-T229 HydrophobicContact CD1-CG2 4.21Å; L225-T229 HydrophobicContact CD1-CG2 4.22Å; P226-T229 WeakPolarHBondContact O-CB 3.47Å; P226-T229 PolarHBondContact O-N 2.93Å; P226-T229 PolarHBondContact O-OG1 2.95Å; P227-T229 PolarHBondContact O-N 3.14Å; T229-A231 WeakPolarHBondContact CG2-O 3.24Å; T229-V252 HydrophobicContact CG2-CG1 4.13Å
230	D	97.9	Very high	96.9	Very high	90 Å²	90	40.5 Å²	40.5	48%	0.481	22%	0.218	S	C	.	.			trans	-74.7	-39.3	-177.8	-61.4	-51.3	0	0	0	112.2	S177 K178	S177-D230 VanDerWaalsContact CA-OD2 3.29Å; S177-D230 WeakPolarHBondContact CA-OD2 3.33Å; K178-D230 PolarHBondContact N-OD2 2.82Å; K178-D230 PolarHBondContact O-N 2.76Å
231	A	98.3	Very high	96.9	Very high	3 Å²	3	42.2 Å²	42.2	3%	0.025	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	140.8	-175.4	0	0	0	0	0	112.9	F173 K178 I179 A180 T229 T253 Y255	F173-A231 HydrophobicContact CD1-CB 3.95Å; F173-A231 HydrophobicContact CE1-CB 3.38Å; F173-A231 HydrophobicContact CZ-CB 4.2Å; K178-A231 PolarHBondContact O-N 3.05Å; I179-A231 CarbonylContact C-O 3.6Å; I179-A231 WeakPolarHBondContact CA-O 3.48Å; I179-A231 HydrophobicContact CG2-CB 4.48Å; A180-A231 PolarHBondContact N-O 3.13Å; T229-A231 WeakPolarHBondContact CG2-O 3.24Å; A231-T253 WeakPolarHBondContact CA-O 3.3Å; A231-Y255 HydrophobicContact CB-CD2 4.08Å; A231-Y255 HydrophobicContact CB-CE2 3.93Å
232	L	98.5	Very high	97	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	112.9	165.7	-174.1	170.3	0	0	0	107.5	M182 L225 F234 L242 A245 V252 T253 A254 Y255	M182-L232 HydrophobicContact SD-CD1 3.94Å; M182-L232 HydrophobicContact SD-CD2 4.36Å; M182-L232 HydrophobicContact SD-CG 3.97Å; L225-L232 HydrophobicContact CD1-CB 4.03Å; L225-L232 HydrophobicContact CD1-CD1 3.78Å; L225-L232 HydrophobicContact CD1-CG 4.01Å; L232-F234 HydrophobicContact CD2-CB 4.03Å; L232-L242 HydrophobicContact CD2-CD1 3.86Å; L232-A245 HydrophobicContact CD1-CB 3.79Å; L232-A245 HydrophobicContact CD2-CB 4.49Å; L232-V252 HydrophobicContact CB-CG1 3.87Å; L232-T253 PolarHBondContact N-O 3.39Å; L232-A254 CarbonylContact O-C 3.53Å; L232-A254 WeakPolarHBondContact O-CA 3.05Å; L232-Y255 PolarHBondContact O-N 3.47Å
233	L	98.6	Very high	97	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	110.4	174.1	-179.3	62.1	0	0	0	109.7	L165 I169 F173 I179 A180 L181 M182 I235	L165-L233 HydrophobicContact CD1-CD2 4.07Å; I169-L233 HydrophobicContact CD1-CD2 3.7Å; I169-L233 HydrophobicContact CG1-CD2 3.58Å; F173-L233 HydrophobicContact CE2-CD2 4.48Å; I179-L233 HydrophobicContact CG2-CB 3.97Å; A180-L233 PolarHBondContact O-N 3.1Å; L181-L233 HydrophobicContact CD2-CB 4.01Å; L181-L233 HydrophobicContact CD2-CD2 3.9Å; L181-L233 HydrophobicContact CD2-CG 4.29Å; M182-L233 PolarHBondContact N-O 3.09Å; L233-I235 HydrophobicContact CG-CD1 4.25Å; L233-I235 WeakPolarHBondContact O-CD1 3.24Å
234	F	98.6	Very high	97	Very high	2 Å²	2	43 Å²	43	1%	0.009	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.9	177.2	-164.4	-82.2	0	0	0	110.7	M182 T184 T217 L232 H241 L242 Y255 K256 Y257	M182-F234 HydrophobicContact CB-CD2 3.94Å; M182-F234 HydrophobicContact CB-CE2 4.36Å; M182-F234 CarbonylContact O-C 3.53Å; M182-F234 VanDerWaalsContact O-CA 3.28Å; M182-F234 WeakPolarHBondContact O-CA 3.41Å; T184-F234 HydrophobicContact CG2-CE1 4.41Å; T184-F234 HydrophobicContact CG2-CZ 4.08Å; T217-F234 HydrophobicContact CG2-CE2 4.32Å; L232-F234 HydrophobicContact CD2-CB 4.03Å; F234-H241 HydrophobicContact CE1-CB 4.18Å; F234-H241 HydrophobicContact CE2-CB 3.96Å; F234-H241 HydrophobicContact CZ-CB 3.37Å; F234-L242 HydrophobicContact CB-CB 4.11Å; F234-L242 HydrophobicContact CB-CD1 3.51Å; F234-L242 HydrophobicContact CB-CD2 4.31Å; F234-L242 HydrophobicContact CB-CG 4.15Å; F234-L242 HydrophobicContact CD1-CB 3.92Å; F234-L242 HydrophobicContact CD2-CB 4Å; F234-L242 HydrophobicContact CD2-CD1 4.22Å; F234-L242 HydrophobicContact CE1-CB 4.4Å; F234-L242 HydrophobicContact CE2-CB 4.45Å; F234-L242 HydrophobicContact CG-CB 3.72Å; F234-L242 HydrophobicContact CG-CD1 3.99Å; F234-L242 HydrophobicContact CG-CG 4.31Å; F234-Y255 PolarHBondContact N-O 2.87Å; F234-K256 CarbonylContact O-C 3.58Å; F234-K256 WeakPolarHBondContact O-CA 3.5Å; F234-Y257 PolarHBondContact O-N 2.91Å
235	I	98.5	Very high	97.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.4	176.7	-63.3	72.6	0	0	0	107.9	F160 L165 L181 M182 S183 F187 L191 L233 Y257 P259	F160-I235 HydrophobicContact CE1-CG2 4.35Å; F160-I235 HydrophobicContact CZ-CG2 4.05Å; L165-I235 HydrophobicContact CD2-CG1 3.82Å; L181-I235 HydrophobicContact CD2-CD1 4.39Å; M182-I235 PolarHBondContact O-N 3.18Å; S183-I235 PolarHBondContact OG-O 3.27Å; S183-I235 VanDerWaalsContact OG-O 3.08Å; F187-I235 HydrophobicContact CB-CG2 4.01Å; F187-I235 HydrophobicContact CD1-CG2 4.49Å; F187-I235 HydrophobicContact CD2-CG2 4.44Å; F187-I235 HydrophobicContact CG-CG2 4.09Å; L191-I235 HydrophobicContact CD2-CB 4.39Å; L191-I235 HydrophobicContact CD2-CD1 3.61Å; L191-I235 HydrophobicContact CD2-CG1 4Å; L233-I235 HydrophobicContact CG-CD1 4.25Å; L233-I235 WeakPolarHBondContact O-CD1 3.24Å; I235-Y257 HydrophobicContact CG2-CD1 4.37Å; I235-P259 HydrophobicContact CG2-CG 3.78Å
236	G	96.9	Very high	97.1	Very high	1 Å²	1	36 Å²	36	1%	0.01	19%	0.194	C	C	.	.	S	Bend	trans	161.1	165	179.9	0	0	0	0	0	113	K256 Y257 D258	G236-K256 WeakPolarHBondContact O-CG 3.36Å; G236-Y257 PolarHBondContact N-O 2.74Å; G236-D258 WeakPolarHBondContact O-CA 3.27Å
237	D	93.5	Very high	97.2	Very high	88 Å²	88	34 Å²	34	47%	0.471	18%	0.181	S	C	.	.	S	Bend	trans	-87.9	-35.6	-179	54.1	-1.9	0	0	0	113	K256 Y260	D237-K256 PolarHBondContact O-NZ 3.02Å; D237-Y260 HydrophobicContact CB-CD2 3.9Å; D237-Y260 HydrophobicContact CB-CE2 4.05Å; D237-Y260 WeakPolarHBondContact OD2-CE2 3.42Å
238	G	93.6	Very high	97.4	Very high	35 Å²	35	28.6 Å²	28.6	36%	0.361	15%	0.146	S	C	.	.			trans	-86.3	163.6	-179.2	0	0	0	0	0	115.6
239	R	96	Very high	97.5	Very high	93 Å²	93	23.8 Å²	23.8	35%	0.351	12%	0.124	S	C	.	.	S	Bend	trans	-98.3	-22.4	174.2	-64.6	-179.5	83.4	-120.5	1.5	113.6	H241 L242 E243 E267 S268	R239-H241 PolarHBondContact O-N 2.96Å; R239-L242 CarbonylContact O-C 3.49Å; R239-L242 PolarHBondContact O-N 3.15Å; R239-L242 VanDerWaalsContact O-N 3.13Å; R239-E243 HydrophobicContact CB-CG 4.3Å; R239-E243 IonicContact CZ-OE1 3.02Å; R239-E243 IonicContact NH1-OE1 2.71Å; R239-E243 PolarHBondContact NH1-OE1 3.37Å; R239-E243 WeakPolarHBondContact O-CB 3.29Å; R239-E243 VanDerWaalsContact O-CG 3.27Å; R239-E243 WeakPolarHBondContact O-CG 3.27Å; R239-E243 PolarHBondContact O-N 2.92Å; R239-E267 IonicContact CZ-OE2 2.68Å; R239-E267 IonicContact NE-OE2 3.05Å; R239-E267 PolarHBondContact NE-OE2 2.84Å; R239-E267 IonicContact NH2-OE2 3.27Å; R239-E267 PolarHBondContact NH2-OE2 3.4Å; R239-S268 PolarHBondContact NH2-O 2.67Å
240	F	96.4	Very high	97.5	Very high	72 Å²	72	25.7 Å²	25.7	32%	0.316	14%	0.136	S	C	.	.	H	α-helix	trans	-50.6	-52.8	-174.2	-179.1	-101.4	0	0	0	113.3	G219 E243 A244 R350 W355	G219-F240 VanDerWaalsContact CA-CE1 3.44Å; F240-E243 PolarHBondContact O-N 2.95Å; F240-A244 PolarHBondContact O-N 3.49Å; F240-R350 VanDerWaalsContact CD2-CZ 3.42Å; F240-R350 HydrophobicContact CE2-CB 3.74Å; F240-R350 HydrophobicContact CE2-CG 3.65Å; F240-R350 VanDerWaalsContact CE2-CZ 3.48Å; F240-R350 HydrophobicContact CZ-CB 3.96Å; F240-R350 HydrophobicContact CZ-CG 3.62Å; F240-R350 PolarHBondContact O-NH1 3.44Å; F240-W355 HydrophobicContact CE2-CH2 4.25Å
241	H	97.4	Very high	97.4	Very high	51 Å²	51	27.3 Å²	27.3	24%	0.236	15%	0.15	C	C	.	.	H	α-helix	trans	-71.1	-39	179.4	-63.4	103.1	0	0	0	113.1	T184 T217 G219 F234 R239 E243 A244 A245	T184-H241 HydrophobicContact CG2-CB 3.91Å; T184-H241 WeakPolarHBondContact CG2-ND1 3.24Å; T217-H241 VanDerWaalsContact CG2-O 3.31Å; T217-H241 WeakPolarHBondContact CG2-O 3.43Å; T217-H241 PolarHBondContact O-CD2 2.91Å; G219-H241 PolarHBondContact N-CD2 2.7Å; G219-H241 VanDerWaalsContact N-CD2 3.3Å; F234-H241 HydrophobicContact CE1-CB 4.18Å; F234-H241 HydrophobicContact CE2-CB 3.96Å; F234-H241 HydrophobicContact CZ-CB 3.37Å; R239-H241 PolarHBondContact O-N 2.96Å; H241-E243 VanDerWaalsContact C-N 3.31Å; H241-E243 PolarHBondContact O-N 3.3Å; H241-A244 WeakPolarHBondContact O-CB 3.37Å; H241-A244 PolarHBondContact O-N 2.67Å; H241-A245 PolarHBondContact O-N 3.23Å
242	L	98.3	Very high	97.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.1	-40.8	174.8	168.7	59.2	0	0	0	111.7	L232 F234 R239 A244 A245 M246 A254 K256 E267	L232-L242 HydrophobicContact CD2-CD1 3.86Å; F234-L242 HydrophobicContact CB-CB 4.11Å; F234-L242 HydrophobicContact CB-CD1 3.51Å; F234-L242 HydrophobicContact CB-CD2 4.31Å; F234-L242 HydrophobicContact CB-CG 4.15Å; F234-L242 HydrophobicContact CD1-CB 3.92Å; F234-L242 HydrophobicContact CD2-CB 4Å; F234-L242 HydrophobicContact CD2-CD1 4.22Å; F234-L242 HydrophobicContact CE1-CB 4.4Å; F234-L242 HydrophobicContact CE2-CB 4.45Å; F234-L242 HydrophobicContact CG-CB 3.72Å; F234-L242 HydrophobicContact CG-CD1 3.99Å; F234-L242 HydrophobicContact CG-CG 4.31Å; R239-L242 CarbonylContact O-C 3.49Å; R239-L242 PolarHBondContact O-N 3.15Å; R239-L242 VanDerWaalsContact O-N 3.13Å; L242-A244 VanDerWaalsContact C-N 3.3Å; L242-A244 PolarHBondContact O-N 2.68Å; L242-A245 CarbonylContact O-C 3.58Å; L242-A245 WeakPolarHBondContact O-CA 3.13Å; L242-A245 WeakPolarHBondContact O-CB 3.4Å; L242-A245 PolarHBondContact O-N 2.94Å; L242-M246 HydrophobicContact CD1-CG 3.99Å; L242-M246 HydrophobicContact CD1-SD 4.48Å; L242-M246 HydrophobicContact CG-CE 4.1Å; L242-M246 HydrophobicContact CG-CG 4.33Å; L242-M246 HydrophobicContact CG-SD 4.42Å; L242-M246 WeakPolarHBondContact O-CG 3.33Å; L242-M246 PolarHBondContact O-N 2.85Å; L242-A254 HydrophobicContact CD1-CB 4.21Å; L242-K256 HydrophobicContact CD2-CB 3.76Å; L242-K256 HydrophobicContact CD2-CD 4.25Å; L242-K256 HydrophobicContact CD2-CG 4.16Å; L242-E267 HydrophobicContact CD2-CB 3.84Å; L242-E267 HydrophobicContact CD2-CG 3.63Å
243	E	98.1	Very high	97.3	Very high	30 Å²	30	31.2 Å²	31.2	14%	0.14	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-38.6	176.7	-72.9	175.5	168	0	0	111.6	R239 F240 H241 A245 M246 I247 Y269 R350	R239-E243 HydrophobicContact CB-CG 4.3Å; R239-E243 IonicContact CZ-OE1 3.02Å; R239-E243 IonicContact NH1-OE1 2.71Å; R239-E243 PolarHBondContact NH1-OE1 3.37Å; R239-E243 WeakPolarHBondContact O-CB 3.29Å; R239-E243 VanDerWaalsContact O-CG 3.27Å; R239-E243 WeakPolarHBondContact O-CG 3.27Å; R239-E243 PolarHBondContact O-N 2.92Å; F240-E243 PolarHBondContact O-N 2.95Å; H241-E243 VanDerWaalsContact C-N 3.31Å; H241-E243 PolarHBondContact O-N 3.3Å; E243-A245 VanDerWaalsContact C-N 3.29Å; E243-A245 PolarHBondContact O-N 3.02Å; E243-M246 HydrophobicContact CB-CE 4.26Å; E243-M246 HydrophobicContact CG-CE 3.64Å; E243-M246 PolarHBondContact O-N 2.77Å; E243-I247 WeakPolarHBondContact O-CB 3.48Å; E243-I247 WeakPolarHBondContact O-CD1 3.39Å; E243-I247 WeakPolarHBondContact O-CG1 3.27Å; E243-I247 PolarHBondContact O-N 3.5Å; E243-Y269 HydrophobicContact CB-CD2 4Å; E243-Y269 HydrophobicContact CB-CE2 4.01Å; E243-Y269 HydrophobicContact CG-CD2 3.8Å; E243-Y269 HydrophobicContact CG-CE2 4.05Å; E243-R350 IonicContact OE2-NH2 3.43Å; E243-R350 PolarHBondContact OE2-NH2 2.72Å
244	A	98.3	Very high	97.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-40.4	172.3	0	0	0	0	0	111.9	T217 L218 A222 F240 H241 L242 I247 A248 M384	T217-A244 HydrophobicContact CG2-CB 4.37Å; L218-A244 WeakPolarHBondContact O-CB 3.35Å; A222-A244 HydrophobicContact CB-CB 4.28Å; A222-A244 WeakPolarHBondContact CB-O 3.45Å; F240-A244 PolarHBondContact O-N 3.49Å; H241-A244 WeakPolarHBondContact O-CB 3.37Å; H241-A244 PolarHBondContact O-N 2.67Å; L242-A244 VanDerWaalsContact C-N 3.3Å; L242-A244 PolarHBondContact O-N 2.68Å; A244-I247 PolarHBondContact O-N 2.76Å; A244-A248 WeakPolarHBondContact O-CB 3.2Å; A244-A248 PolarHBondContact O-N 3.27Å; A244-A248 VanDerWaalsContact O-N 3.11Å; A244-M384 HydrophobicContact CB-CE 3.64Å
245	A	98.4	Very high	97.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-41.1	174.4	0	0	0	0	0	112.3	M182 T217 L232 H241 L242 E243 A248 N249	M182-A245 HydrophobicContact CE-CB 4.01Å; M182-A245 HydrophobicContact SD-CB 4.13Å; T217-A245 HydrophobicContact CG2-CB 4.25Å; L232-A245 HydrophobicContact CD1-CB 3.79Å; L232-A245 HydrophobicContact CD2-CB 4.49Å; H241-A245 PolarHBondContact O-N 3.23Å; L242-A245 CarbonylContact O-C 3.58Å; L242-A245 WeakPolarHBondContact O-CA 3.13Å; L242-A245 WeakPolarHBondContact O-CB 3.4Å; L242-A245 PolarHBondContact O-N 2.94Å; E243-A245 VanDerWaalsContact C-N 3.29Å; E243-A245 PolarHBondContact O-N 3.02Å; A245-A248 PolarHBondContact O-N 2.87Å; A245-N249 WeakPolarHBondContact O-CB 3.4Å; A245-N249 PolarHBondContact O-N 3.21Å; A245-N249 VanDerWaalsContact O-N 3.08Å; A245-N249 PolarHBondContact O-ND2 3.35Å
246	M	98.5	Very high	97.3	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.03	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-40.9	175.5	-67.7	-168.7	-70	0	0	112.1	L242 E243 A248 N249 A254 E267 Y269 H271	L242-M246 HydrophobicContact CD1-CG 3.99Å; L242-M246 HydrophobicContact CD1-SD 4.48Å; L242-M246 HydrophobicContact CG-CE 4.1Å; L242-M246 HydrophobicContact CG-CG 4.33Å; L242-M246 HydrophobicContact CG-SD 4.42Å; L242-M246 WeakPolarHBondContact O-CG 3.33Å; L242-M246 PolarHBondContact O-N 2.85Å; E243-M246 HydrophobicContact CB-CE 4.26Å; E243-M246 HydrophobicContact CG-CE 3.64Å; E243-M246 PolarHBondContact O-N 2.77Å; M246-A248 VanDerWaalsContact C-N 3.31Å; M246-A248 PolarHBondContact O-N 2.81Å; M246-N249 CarbonylContact O-C 3.53Å; M246-N249 VanDerWaalsContact O-C 3.25Å; M246-N249 PolarHBondContact O-N 2.93Å; M246-A254 HydrophobicContact CG-CB 3.62Å; M246-A254 HydrophobicContact SD-CB 3.68Å; M246-E267 HydrophobicContact CE-CB 4.47Å; M246-E267 HydrophobicContact SD-CB 4.09Å; M246-Y269 HydrophobicContact CE-CD2 4.32Å; M246-H271 PolarHBondContact O-NE2 3.43Å
247	I	98.2	Very high	97.4	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-44.7	176.1	-69.8	162.4	0	0	0	110.2	E243 A244 N249 Y269 M274 I353 V381 Y382 M384	E243-I247 WeakPolarHBondContact O-CB 3.48Å; E243-I247 WeakPolarHBondContact O-CD1 3.39Å; E243-I247 WeakPolarHBondContact O-CG1 3.27Å; E243-I247 PolarHBondContact O-N 3.5Å; A244-I247 PolarHBondContact O-N 2.76Å; I247-N249 VanDerWaalsContact C-N 3.28Å; I247-N249 PolarHBondContact O-N 3.31Å; I247-Y269 HydrophobicContact CD1-CE1 3.97Å; I247-Y269 HydrophobicContact CD1-CE2 4.19Å; I247-Y269 HydrophobicContact CG1-CD1 3.81Å; I247-Y269 HydrophobicContact CG1-CE1 3.41Å; I247-Y269 VanDerWaalsContact CG1-CE1 3.41Å; I247-Y269 HydrophobicContact CG1-CE2 4.22Å; I247-Y269 HydrophobicContact CG1-CG 4.37Å; I247-M274 HydrophobicContact CB-CE 4.4Å; I247-M274 HydrophobicContact CD1-CE 4.31Å; I247-M274 HydrophobicContact CG1-CE 3.96Å; I247-M274 HydrophobicContact CG2-CE 3.57Å; I247-I353 HydrophobicContact CD1-CG2 4.17Å; I247-V381 WeakPolarHBondContact O-CG1 3.17Å; I247-Y382 HydrophobicContact CG2-CD1 4.26Å; I247-Y382 HydrophobicContact CG2-CG 4.43Å; I247-M384 HydrophobicContact CB-CG 3.97Å; I247-M384 HydrophobicContact CB-SD 4.25Å; I247-M384 HydrophobicContact CD1-CE 4.34Å; I247-M384 HydrophobicContact CD1-SD 4.26Å; I247-M384 HydrophobicContact CG2-CG 3.6Å; I247-M384 HydrophobicContact CG2-SD 3.7Å
248	A	97.8	Very high	97.6	Very high	6 Å²	6	31.7 Å²	31.7	5%	0.05	17%	0.172	C	C	.	.	H	α-helix	trans	-72.7	-18.2	179.1	0	0	0	0	0	114	A222 A244 A245 M246 V381 M384	A222-A248 HydrophobicContact CB-CB 4.01Å; A244-A248 WeakPolarHBondContact O-CB 3.2Å; A244-A248 PolarHBondContact O-N 3.27Å; A244-A248 VanDerWaalsContact O-N 3.11Å; A245-A248 PolarHBondContact O-N 2.87Å; M246-A248 VanDerWaalsContact C-N 3.31Å; M246-A248 PolarHBondContact O-N 2.81Å; A248-V381 WeakPolarHBondContact O-CG1 3.32Å; A248-M384 HydrophobicContact CB-CB 4.22Å; A248-M384 HydrophobicContact CB-CG 4.25Å
249	N	98.2	Very high	97.6	Very high	9 Å²	9	30.6 Å²	30.6	5%	0.048	16%	0.159	C	C	.	.			trans	-136.4	62.2	-173.1	-57.8	-73.6	0	0	0	111.9	A223 K224 L225 A245 M246 I247 T251 V252	A223-N249 PolarHBondContact O-ND2 3.34Å; K224-N249 WeakPolarHBondContact CA-OD1 3.48Å; L225-N249 WeakPolarHBondContact CB-OD1 3.36Å; L225-N249 HydrophobicContact CD1-CB 4.22Å; L225-N249 HydrophobicContact CG-CB 4.44Å; L225-N249 WeakPolarHBondContact CG-OD1 3.4Å; L225-N249 PolarHBondContact N-OD1 3.3Å; A245-N249 WeakPolarHBondContact O-CB 3.4Å; A245-N249 PolarHBondContact O-N 3.21Å; A245-N249 VanDerWaalsContact O-N 3.08Å; A245-N249 PolarHBondContact O-ND2 3.35Å; M246-N249 CarbonylContact O-C 3.53Å; M246-N249 VanDerWaalsContact O-C 3.25Å; M246-N249 PolarHBondContact O-N 2.93Å; I247-N249 VanDerWaalsContact C-N 3.28Å; I247-N249 PolarHBondContact O-N 3.31Å; N249-T251 PolarHBondContact O-N 3.3Å; N249-T251 VanDerWaalsContact O-N 3.1Å; N249-V252 HydrophobicContact CB-CB 4.46Å; N249-V252 HydrophobicContact CB-CG2 4.29Å; N249-V252 PolarHBondContact O-N 3.07Å
250	P	97.4	Very high	97.5	Very high	48 Å²	48	31.2 Å²	31.2	31%	0.312	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.5	-170.4	24.9	-35	0	0	0	114.9	H271 V381	P250-H271 WeakPolarHBondContact CB-NE2 3.41Å; P250-V381 HydrophobicContact CG-CG1 4.25Å; P250-V381 HydrophobicContact CG-CG2 3.88Å
251	T	95.7	Very high	97.5	Very high	124 Å²	124	30.2 Å²	30.2	76%	0.761	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-6.7	-175.6	58.7	0	0	0	0	113.8	N249	N249-T251 PolarHBondContact O-N 3.3Å; N249-T251 VanDerWaalsContact O-N 3.1Å
252	V	97.5	Very high	97.4	Very high	17 Å²	17	34.8 Å²	34.8	10%	0.103	18%	0.179	C	C	.	.	S	Bend	trans	-98.7	132.3	-176.6	-175.8	0	0	0	0	109.6	L225 T229 L232 N249 A254	L225-V252 HydrophobicContact CD1-CB 4.45Å; L225-V252 HydrophobicContact CD1-CG1 4.22Å; L225-V252 HydrophobicContact CD1-CG2 4.23Å; T229-V252 HydrophobicContact CG2-CG1 4.13Å; L232-V252 HydrophobicContact CB-CG1 3.87Å; N249-V252 HydrophobicContact CB-CB 4.46Å; N249-V252 HydrophobicContact CB-CG2 4.29Å; N249-V252 PolarHBondContact O-N 3.07Å; V252-A254 PolarHBondContact O-N 3.04Å
253	T	97.6	Very high	97.3	Very high	70 Å²	70	41.3 Å²	41.3	43%	0.429	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	121.9	176.6	-56.1	0	0	0	0	109.8	A231 L232 Y255 I266	A231-T253 WeakPolarHBondContact CA-O 3.3Å; L232-T253 PolarHBondContact N-O 3.39Å; T253-Y255 HydrophobicContact CG2-CD2 4.29Å; T253-Y255 HydrophobicContact CG2-CE2 3.51Å; T253-I266 HydrophobicContact CG2-CG2 4.31Å
254	A	98.5	Very high	97.3	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.041	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.7	-176.5	0	0	0	0	0	112.2	L232 L242 M246 V252 E267	L232-A254 CarbonylContact O-C 3.53Å; L232-A254 WeakPolarHBondContact O-CA 3.05Å; L242-A254 HydrophobicContact CD1-CB 4.21Å; M246-A254 HydrophobicContact CG-CB 3.62Å; M246-A254 HydrophobicContact SD-CB 3.68Å; V252-A254 PolarHBondContact O-N 3.04Å; A254-E267 PolarHBondContact O-N 2.8Å
255	Y	98.5	Very high	97.2	Very high	43 Å²	43	44.1 Å²	44.1	17%	0.169	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.2	176.4	-64.2	-103.2	0	0	0	109	F173 A231 L232 F234 T253 T265 I266	F173-Y255 HydrophobicContact CE1-CD1 4.34Å; F173-Y255 AromaticContact CE1-CD2 3.8Å; F173-Y255 HydrophobicContact CE1-CD2 3.8Å; F173-Y255 HydrophobicContact CE1-CE1 4.09Å; F173-Y255 AromaticContact CE1-CE2 3.55Å; F173-Y255 HydrophobicContact CE1-CE2 3.55Å; F173-Y255 HydrophobicContact CE1-CG 4.21Å; F173-Y255 AromaticContact CE1-CZ 3.71Å; F173-Y255 AromaticContact CZ-CD1 3.9Å; F173-Y255 HydrophobicContact CZ-CD1 3.9Å; F173-Y255 AromaticContact CZ-CD2 3.79Å; F173-Y255 HydrophobicContact CZ-CD2 3.79Å; F173-Y255 HydrophobicContact CZ-CE1 4.05Å; F173-Y255 AromaticContact CZ-CE2 3.98Å; F173-Y255 HydrophobicContact CZ-CE2 3.98Å; F173-Y255 AromaticContact CZ-CG 3.77Å; F173-Y255 HydrophobicContact CZ-CG 3.77Å; A231-Y255 HydrophobicContact CB-CD2 4.08Å; A231-Y255 HydrophobicContact CB-CE2 3.93Å; L232-Y255 PolarHBondContact O-N 3.47Å; F234-Y255 PolarHBondContact N-O 2.87Å; T253-Y255 HydrophobicContact CG2-CD2 4.29Å; T253-Y255 HydrophobicContact CG2-CE2 3.51Å; Y255-T265 CarbonylContact C-O 3.58Å; Y255-T265 WeakPolarHBondContact CA-O 3.44Å; Y255-I266 HydrophobicContact CD1-CG1 3.83Å; Y255-I266 HydrophobicContact CE1-CD1 4.1Å; Y255-I266 HydrophobicContact CE1-CG1 3.48Å; Y255-I266 VanDerWaalsContact CE1-CG1 3.48Å
256	K	98.4	Very high	97.2	Very high	28 Å²	28	49.9 Å²	49.9	12%	0.122	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.3	170.3	-170.5	-179.9	68.8	161.5	0	109.8	F234 G236 D237 L242 C264 T265 E267	F234-K256 CarbonylContact O-C 3.58Å; F234-K256 WeakPolarHBondContact O-CA 3.5Å; G236-K256 WeakPolarHBondContact O-CG 3.36Å; D237-K256 PolarHBondContact O-NZ 3.02Å; L242-K256 HydrophobicContact CD2-CB 3.76Å; L242-K256 HydrophobicContact CD2-CD 4.25Å; L242-K256 HydrophobicContact CD2-CG 4.16Å; K256-C264 CarbonylContact O-C 3.58Å; K256-C264 VanDerWaalsContact O-CA 3.24Å; K256-C264 WeakPolarHBondContact O-CA 3.17Å; K256-T265 PolarHBondContact N-O 3.25Å; K256-T265 PolarHBondContact O-N 2.84Å; K256-E267 HydrophobicContact CB-CG 3.71Å
257	Y	98.4	Very high	97.2	Very high	1 Å²	1	51 Å²	51	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	115.9	165.3	176.7	-96.9	0	0	0	109.6	F160 H164 L165 T168 F234 I235 G236 P259 K263 C264	F160-Y257 HydrophobicContact CD2-CE1 4.16Å; F160-Y257 HydrophobicContact CE2-CE1 4.06Å; H164-Y257 AromaticContact CE1-CE2 3.93Å; H164-Y257 AromaticContact ND1-CE2 3.58Å; H164-Y257 AromaticContact ND1-CZ 3.64Å; H164-Y257 PolarHBondContact ND1-OH 2.93Å; L165-Y257 HydrophobicContact CB-CD1 4.45Å; L165-Y257 HydrophobicContact CB-CE1 3.94Å; L165-Y257 HydrophobicContact CB-CE2 4.49Å; L165-Y257 HydrophobicContact CD1-CD1 3.74Å; L165-Y257 HydrophobicContact CD1-CD2 3.97Å; L165-Y257 HydrophobicContact CD1-CE1 4.09Å; L165-Y257 HydrophobicContact CD1-CE2 4.31Å; L165-Y257 HydrophobicContact CD1-CG 3.66Å; L165-Y257 HydrophobicContact CD2-CD1 4.35Å; L165-Y257 HydrophobicContact CD2-CE1 4.43Å; L165-Y257 HydrophobicContact CG-CD1 4.41Å; L165-Y257 HydrophobicContact CG-CE1 4.38Å; T168-Y257 HydrophobicContact CG2-CD2 4.16Å; T168-Y257 HydrophobicContact CG2-CE2 4.38Å; F234-Y257 PolarHBondContact O-N 2.91Å; I235-Y257 HydrophobicContact CG2-CD1 4.37Å; G236-Y257 PolarHBondContact N-O 2.74Å; Y257-P259 HydrophobicContact CD1-CG 4.21Å; Y257-P259 HydrophobicContact CE1-CB 4.23Å; Y257-P259 HydrophobicContact CE1-CG 4.15Å; Y257-P259 WeakPolarHBondContact O-CD 3.49Å; Y257-K263 WeakPolarHBondContact CA-O 3.47Å; Y257-C264 HydrophobicContact CD2-CB 4.43Å
258	D	97.5	Very high	97.1	Very high	26 Å²	26	55.5 Å²	55.5	14%	0.139	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	112.4	174.3	173.4	-6.6	0	0	0	109.8	G236 Y260 S261 R262 K263	G236-D258 WeakPolarHBondContact O-CA 3.27Å; D258-Y260 PolarHBondContact O-N 3.22Å; D258-Y260 WeakPolarHBondContact OD1-CA 3.29Å; D258-Y260 WeakPolarHBondContact OD1-CB 3.29Å; D258-Y260 PolarHBondContact OD1-N 2.95Å; D258-S261 WeakPolarHBondContact CB-OG 2.96Å; D258-S261 PolarHBondContact OD1-N 3.18Å; D258-S261 VanDerWaalsContact OD2-CB 3.28Å; D258-S261 WeakPolarHBondContact OD2-CB 3.43Å; D258-S261 PolarHBondContact OD2-OG 3.3Å; D258-R262 VanDerWaalsContact O-CA 3.25Å; D258-R262 WeakPolarHBondContact O-CA 3.45Å; D258-R262 PolarHBondContact O-N 2.73Å; D258-K263 PolarHBondContact N-O 2.82Å
259	P	95.4	Very high	97.1	Very high	11 Å²	11	57 Å²	57	7%	0.071	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.2	-178.2	-23.2	36.4	0	0	0	114.7	F160 F187 I235 Y257	F160-P259 HydrophobicContact CB-CB 3.65Å; F160-P259 HydrophobicContact CD1-CB 4.2Å; F160-P259 HydrophobicContact CD1-CG 4.42Å; F160-P259 HydrophobicContact CD2-CB 3.97Å; F160-P259 HydrophobicContact CD2-CG 4.44Å; F160-P259 HydrophobicContact CG-CB 3.69Å; F160-P259 HydrophobicContact CG-CG 4.28Å; F187-P259 HydrophobicContact CD1-CG 4.17Å; F187-P259 HydrophobicContact CE1-CB 4.2Å; F187-P259 HydrophobicContact CE1-CG 3.76Å; F187-P259 HydrophobicContact CZ-CG 4.07Å; I235-P259 HydrophobicContact CG2-CG 3.78Å; Y257-P259 HydrophobicContact CD1-CG 4.21Å; Y257-P259 HydrophobicContact CE1-CB 4.23Å; Y257-P259 HydrophobicContact CE1-CG 4.15Å; Y257-P259 WeakPolarHBondContact O-CD 3.49Å
260	Y	93.4	Very high	97	Very high	107 Å²	107	61 Å²	61	42%	0.42	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-52.9	-179.8	-57.8	-75.8	0	0	0	111	Y60 F187 D237 D258 R262	Y60-Y260 PolarHBondContact OH-OH 3.35Å; F187-Y260 HydrophobicContact CZ-CE2 4.4Å; D237-Y260 HydrophobicContact CB-CD2 3.9Å; D237-Y260 HydrophobicContact CB-CE2 4.05Å; D237-Y260 WeakPolarHBondContact OD2-CE2 3.42Å; D258-Y260 PolarHBondContact O-N 3.22Å; D258-Y260 WeakPolarHBondContact OD1-CA 3.29Å; D258-Y260 WeakPolarHBondContact OD1-CB 3.29Å; D258-Y260 PolarHBondContact OD1-N 2.95Å; Y260-R262 VanDerWaalsContact C-N 3.29Å; Y260-R262 PolarHBondContact O-N 2.9Å
261	S	95.5	Very high	97	Very high	51 Å²	51	60.5 Å²	60.5	36%	0.357	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-11.3	-179.6	72.5	0	0	0	0	113.6	D258 K263	D258-S261 WeakPolarHBondContact CB-OG 2.96Å; D258-S261 PolarHBondContact OD1-N 3.18Å; D258-S261 VanDerWaalsContact OD2-CB 3.28Å; D258-S261 WeakPolarHBondContact OD2-CB 3.43Å; D258-S261 PolarHBondContact OD2-OG 3.3Å; S261-K263 PolarHBondContact O-N 2.84Å
262	R	95.8	Very high	97.1	Very high	147 Å²	147	62.4 Å²	62.4	56%	0.555	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	31.4	-177.3	-61.2	-173.3	-170.6	-177	3.3	113	H164 D258 Y260	H164-R262 PolarHBondContact CE1-O 3.39Å; D258-R262 VanDerWaalsContact O-CA 3.25Å; D258-R262 WeakPolarHBondContact O-CA 3.45Å; D258-R262 PolarHBondContact O-N 2.73Å; Y260-R262 VanDerWaalsContact C-N 3.29Å; Y260-R262 PolarHBondContact O-N 2.9Å
263	K	96.2	Very high	97.1	Very high	136 Å²	136	64.4 Å²	64.4	59%	0.591	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	136.9	179.3	-67.7	175.6	-175.7	172.8	0	109.8	Y257 D258 S261	Y257-K263 WeakPolarHBondContact CA-O 3.47Å; D258-K263 PolarHBondContact N-O 2.82Å; S261-K263 PolarHBondContact O-N 2.84Å
264	C	97.2	Very high	97.1	Very high	37 Å²	37	61.5 Å²	61.5	25%	0.25	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.5	164.1	-169.4	0	0	0	0	108.4	T168 K256 Y257	T168-C264 HydrophobicContact CG2-CB 3.59Å; K256-C264 CarbonylContact O-C 3.58Å; K256-C264 VanDerWaalsContact O-CA 3.24Å; K256-C264 WeakPolarHBondContact O-CA 3.17Å; Y257-C264 HydrophobicContact CD2-CB 4.43Å
265	T	97.7	Very high	97	Very high	53 Å²	53	63.3 Å²	63.3	33%	0.325	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.9	179.5	49.8	0	0	0	0	110.2	Y255 K256 E267	Y255-T265 CarbonylContact C-O 3.58Å; Y255-T265 WeakPolarHBondContact CA-O 3.44Å; K256-T265 PolarHBondContact N-O 3.25Å; K256-T265 PolarHBondContact O-N 2.84Å; T265-E267 PolarHBondContact OG1-OE1 2.95Å
266	I	97.7	Very high	96.9	Very high	120 Å²	120	69.5 Å²	69.5	62%	0.615	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.5	166.2	-59.7	172.2	0	0	0	106.9	T253 Y255	T253-I266 HydrophobicContact CG2-CG2 4.31Å; Y255-I266 HydrophobicContact CD1-CG1 3.83Å; Y255-I266 HydrophobicContact CE1-CD1 4.1Å; Y255-I266 HydrophobicContact CE1-CG1 3.48Å; Y255-I266 VanDerWaalsContact CE1-CG1 3.48Å
267	E	98	Very high	96.9	Very high	30 Å²	30	70 Å²	70	14%	0.14	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144.2	-175.5	-62.9	-71.5	161.9	0	0	110	R239 L242 M246 A254 K256 T265	R239-E267 IonicContact CZ-OE2 2.68Å; R239-E267 IonicContact NE-OE2 3.05Å; R239-E267 PolarHBondContact NE-OE2 2.84Å; R239-E267 IonicContact NH2-OE2 3.27Å; R239-E267 PolarHBondContact NH2-OE2 3.4Å; L242-E267 HydrophobicContact CD2-CB 3.84Å; L242-E267 HydrophobicContact CD2-CG 3.63Å; M246-E267 HydrophobicContact CE-CB 4.47Å; M246-E267 HydrophobicContact SD-CB 4.09Å; A254-E267 PolarHBondContact O-N 2.8Å; K256-E267 HydrophobicContact CB-CG 3.71Å; T265-E267 PolarHBondContact OG1-OE1 2.95Å
268	S	97.1	Very high	96.9	Very high	96 Å²	96	70 Å²	70	67%	0.671	34%	0.344	S	S	*	.			trans	-128.5	147.8	176.7	60.8	0	0	0	0	110.6	R239	R239-S268 PolarHBondContact NH2-O 2.67Å
269	Y	97.5	Very high	96.9	Very high	39 Å²	39	74.3 Å²	74.3	15%	0.153	36%	0.358	C	S	.	.			trans	-116.7	140.1	169.7	-167.6	-102.1	0	0	0	109.1	E243 M246 I247 H271 M274	E243-Y269 HydrophobicContact CB-CD2 4Å; E243-Y269 HydrophobicContact CB-CE2 4.01Å; E243-Y269 HydrophobicContact CG-CD2 3.8Å; E243-Y269 HydrophobicContact CG-CE2 4.05Å; M246-Y269 HydrophobicContact CE-CD2 4.32Å; I247-Y269 HydrophobicContact CD1-CE1 3.97Å; I247-Y269 HydrophobicContact CD1-CE2 4.19Å; I247-Y269 HydrophobicContact CG1-CD1 3.81Å; I247-Y269 HydrophobicContact CG1-CE1 3.41Å; I247-Y269 VanDerWaalsContact CG1-CE1 3.41Å; I247-Y269 HydrophobicContact CG1-CE2 4.22Å; I247-Y269 HydrophobicContact CG1-CG 4.37Å; Y269-H271 VanDerWaalsContact C-N 3.34Å; Y269-H271 AromaticContact CD1-CD2 3.91Å; Y269-H271 AromaticContact CD1-NE2 4Å; Y269-H271 PolarHBondContact O-N 2.96Å; Y269-H271 VanDerWaalsContact O-N 3.09Å; Y269-H271 PolarHBondContact O-ND1 2.98Å; Y269-H271 VanDerWaalsContact O-ND1 3.1Å; Y269-M274 HydrophobicContact CE1-CB 3.72Å; Y269-M274 HydrophobicContact CE1-CE 4.13Å; Y269-M274 HydrophobicContact CE1-CG 3.99Å; Y269-M274 WeakPolarHBondContact OH-CG 3.25Å
270	N	97.1	Very high	97	Very high	91 Å²	91	76.7 Å²	76.7	49%	0.487	37%	0.374	S	S	.	.			trans	-86.7	79.2	178.8	-166	-30.7	0	0	0	110	E272 V273 M274	N270-E272 VanDerWaalsContact C-N 3.29Å; N270-E272 PolarHBondContact O-N 3.14Å; N270-V273 HydrophobicContact CB-CB 4.2Å; N270-V273 HydrophobicContact CB-CG2 4.46Å; N270-V273 WeakPolarHBondContact ND2-CG2 3.34Å; N270-V273 PolarHBondContact O-N 3.07Å; N270-V273 WeakPolarHBondContact OD1-CB 3.48Å; N270-V273 VanDerWaalsContact OD1-CG2 3.27Å; N270-V273 WeakPolarHBondContact OD1-CG2 3.28Å; N270-V273 PolarHBondContact OD1-N 3.25Å; N270-M274 PolarHBondContact O-N 2.84Å
271	H	97.2	Very high	97.2	Very high	38 Å²	38	72.1 Å²	72.1	18%	0.176	36%	0.358	C	S	.	.	H	α-helix	trans	-60.1	-37.5	-179.6	-60	86	0	0	0	112.4	M246 P250 Y269 M274 Q275	M246-H271 PolarHBondContact O-NE2 3.43Å; P250-H271 WeakPolarHBondContact CB-NE2 3.41Å; Y269-H271 VanDerWaalsContact C-N 3.34Å; Y269-H271 AromaticContact CD1-CD2 3.91Å; Y269-H271 AromaticContact CD1-NE2 4Å; Y269-H271 PolarHBondContact O-N 2.96Å; Y269-H271 VanDerWaalsContact O-N 3.09Å; Y269-H271 PolarHBondContact O-ND1 2.98Å; Y269-H271 VanDerWaalsContact O-ND1 3.1Å; H271-M274 PolarHBondContact O-N 3.25Å; H271-Q275 WeakPolarHBondContact O-CB 3.27Å; H271-Q275 VanDerWaalsContact O-CG 3.27Å; H271-Q275 WeakPolarHBondContact O-CG 3.26Å; H271-Q275 PolarHBondContact O-N 3.33Å
272	E	96.7	Very high	97.4	Very high	165 Å²	165	69.9 Å²	69.9	77%	0.771	34%	0.342	S	S	*	.	H	α-helix	trans	-62	-47.7	178.9	-65.7	-177.2	176.7	0	0	111.8	N270 R276	N270-E272 VanDerWaalsContact C-N 3.29Å; N270-E272 PolarHBondContact O-N 3.14Å; E272-R276 WeakPolarHBondContact O-CB 3.39Å; E272-R276 PolarHBondContact O-N 3.48Å
273	V	97	Very high	97.5	Very high	58 Å²	58	66.9 Å²	66.9	35%	0.352	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-46.7	177.2	170.2	0	0	0	0	110.4	N270 T277	N270-V273 HydrophobicContact CB-CB 4.2Å; N270-V273 HydrophobicContact CB-CG2 4.46Å; N270-V273 WeakPolarHBondContact ND2-CG2 3.34Å; N270-V273 PolarHBondContact O-N 3.07Å; N270-V273 WeakPolarHBondContact OD1-CB 3.48Å; N270-V273 VanDerWaalsContact OD1-CG2 3.27Å; N270-V273 WeakPolarHBondContact OD1-CG2 3.28Å; N270-V273 PolarHBondContact OD1-N 3.25Å; V273-T277 VanDerWaalsContact O-CB 3.28Å; V273-T277 WeakPolarHBondContact O-CB 3.11Å; V273-T277 PolarHBondContact O-N 3.32Å; V273-T277 PolarHBondContact O-OG1 3.04Å
274	M	97.6	Very high	97.5	Very high	10 Å²	10	65.1 Å²	65.1	5%	0.049	33%	0.331	C	S	.	.	H	α-helix	trans	-59.2	-54.4	178.9	-175.7	-85.3	-92	0	0	110.7	I247 Y269 N270 H271 R276 T277 R278 I353 Y382	I247-M274 HydrophobicContact CB-CE 4.4Å; I247-M274 HydrophobicContact CD1-CE 4.31Å; I247-M274 HydrophobicContact CG1-CE 3.96Å; I247-M274 HydrophobicContact CG2-CE 3.57Å; Y269-M274 HydrophobicContact CE1-CB 3.72Å; Y269-M274 HydrophobicContact CE1-CE 4.13Å; Y269-M274 HydrophobicContact CE1-CG 3.99Å; Y269-M274 WeakPolarHBondContact OH-CG 3.25Å; N270-M274 PolarHBondContact O-N 2.84Å; H271-M274 PolarHBondContact O-N 3.25Å; M274-R276 PolarHBondContact O-N 3.36Å; M274-T277 PolarHBondContact O-N 3.37Å; M274-R278 HydrophobicContact CG-CG 4.32Å; M274-R278 VanDerWaalsContact O-CG 3.3Å; M274-R278 WeakPolarHBondContact O-CG 3.44Å; M274-R278 PolarHBondContact O-N 3.32Å; M274-R278 HydrophobicContact SD-CG 3.8Å; M274-I353 HydrophobicContact CG-CG2 4.07Å; M274-Y382 HydrophobicContact CE-CD1 4.5Å; M274-Y382 HydrophobicContact CE-CD2 4.31Å; M274-Y382 HydrophobicContact CE-CG 3.93Å; M274-Y382 HydrophobicContact SD-CD2 4.18Å; M274-Y382 HydrophobicContact SD-CG 4.4Å
275	Q	97	Very high	97.6	Very high	43 Å²	43	63.3 Å²	63.3	20%	0.201	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-43.9	-178.2	-70.6	-168.4	32	0	0	112.4	H271 T277 R278 R279 W378 T380	H271-Q275 WeakPolarHBondContact O-CB 3.27Å; H271-Q275 VanDerWaalsContact O-CG 3.27Å; H271-Q275 WeakPolarHBondContact O-CG 3.26Å; H271-Q275 PolarHBondContact O-N 3.33Å; Q275-T277 PolarHBondContact O-N 3.21Å; Q275-R278 PolarHBondContact O-N 3.28Å; Q275-R279 WeakPolarHBondContact O-CB 3.45Å; Q275-R279 VanDerWaalsContact O-CG 3.32Å; Q275-R279 WeakPolarHBondContact O-CG 3.37Å; Q275-R279 PolarHBondContact O-N 3.04Å; Q275-W378 HydrophobicContact CB-CZ2 4.34Å; Q275-W378 HydrophobicContact CG-CZ2 4.24Å; Q275-T380 PolarHBondContact NE2-O 3.42Å
276	R	97.3	Very high	97.6	Very high	172 Å²	172	65.2 Å²	65.2	65%	0.649	32%	0.323	S	S	*	.	H	α-helix	trans	-60.8	-46.5	177.7	178.4	178.8	58.8	168.8	-2.5	111.6	E272 M274 R279 C280	E272-R276 WeakPolarHBondContact O-CB 3.39Å; E272-R276 PolarHBondContact O-N 3.48Å; M274-R276 PolarHBondContact O-N 3.36Å; R276-R279 PolarHBondContact O-N 3.48Å; R276-C280 WeakPolarHBondContact O-CB 3.34Å; R276-C280 PolarHBondContact O-N 2.84Å
277	T	97.3	Very high	97.6	Very high	39 Å²	39	65 Å²	65	24%	0.239	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-46.1	178.8	-67.9	0	0	0	0	111.4	V273 M274 Q275 C280 A281 V357	V273-T277 VanDerWaalsContact O-CB 3.28Å; V273-T277 WeakPolarHBondContact O-CB 3.11Å; V273-T277 PolarHBondContact O-N 3.32Å; V273-T277 PolarHBondContact O-OG1 3.04Å; M274-T277 PolarHBondContact O-N 3.37Å; Q275-T277 PolarHBondContact O-N 3.21Å; T277-C280 WeakPolarHBondContact O-CB 3.09Å; T277-C280 PolarHBondContact O-N 3.46Å; T277-A281 PolarHBondContact O-N 3.05Å; T277-A281 VanDerWaalsContact O-N 3.09Å; T277-V357 HydrophobicContact CG2-CG1 3.24Å
278	R	98.2	Very high	97.6	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-67.1	-40.5	179.8	-63.6	-36.7	-62.4	154.2	12.6	112.3	M274 Q275 A281 I282 S352 L363 E368 W378 Y382	M274-R278 HydrophobicContact CG-CG 4.32Å; M274-R278 VanDerWaalsContact O-CG 3.3Å; M274-R278 WeakPolarHBondContact O-CG 3.44Å; M274-R278 PolarHBondContact O-N 3.32Å; M274-R278 HydrophobicContact SD-CG 3.8Å; Q275-R278 PolarHBondContact O-N 3.28Å; R278-A281 PolarHBondContact O-N 2.78Å; R278-I282 WeakPolarHBondContact O-CG1 3.43Å; R278-I282 PolarHBondContact O-N 3.03Å; R278-S352 VanDerWaalsContact CZ-O 3.25Å; R278-S352 PolarHBondContact NH1-O 2.92Å; R278-L363 PolarHBondContact NH1-O 2.85Å; R278-L363 PolarHBondContact NH2-O 2.81Å; R278-E368 WeakPolarHBondContact CB-OE1 3.45Å; R278-E368 WeakPolarHBondContact CG-OE1 3.33Å; R278-E368 IonicContact CZ-OE1 2.68Å; R278-E368 VanDerWaalsContact CZ-OE1 3.31Å; R278-E368 IonicContact CZ-OE2 3.61Å; R278-E368 IonicContact NE-OE1 2.8Å; R278-E368 PolarHBondContact NE-OE1 2.58Å; R278-E368 IonicContact NE-OE2 2.87Å; R278-E368 IonicContact NH2-OE1 2.92Å; R278-E368 PolarHBondContact NH2-OE1 2.94Å; R278-E368 VanDerWaalsContact NH2-OE1 3.12Å; R278-E368 IonicContact NH2-OE2 3.42Å; R278-E368 PolarHBondContact NH2-OE2 3.49Å; R278-W378 HydrophobicContact CB-CH2 3.92Å; R278-W378 HydrophobicContact CB-CZ3 4.5Å; R278-Y382 HydrophobicContact CG-CE2 4.43Å
279	R	97.4	Very high	97.6	Very high	115 Å²	115	64.3 Å²	64.3	43%	0.434	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-42.4	172.5	-75.2	-175.6	-177.5	-162.3	5	112.6	Q275 R276 A281 I282 D283 W378	Q275-R279 WeakPolarHBondContact O-CB 3.45Å; Q275-R279 VanDerWaalsContact O-CG 3.32Å; Q275-R279 WeakPolarHBondContact O-CG 3.37Å; Q275-R279 PolarHBondContact O-N 3.04Å; R276-R279 PolarHBondContact O-N 3.48Å; R279-A281 VanDerWaalsContact C-N 3.3Å; R279-A281 PolarHBondContact O-N 2.97Å; R279-I282 WeakPolarHBondContact O-CB 3.4Å; R279-I282 PolarHBondContact O-N 3.41Å; R279-I282 VanDerWaalsContact O-N 3.15Å; R279-D283 PolarHBondContact O-N 3.18Å; R279-W378 HydrophobicContact CG-CD2 4.3Å; R279-W378 HydrophobicContact CG-CE3 4.47Å; R279-W378 HydrophobicContact CG-CH2 4.25Å; R279-W378 HydrophobicContact CG-CZ2 4.1Å; R279-W378 HydrophobicContact CG-CZ3 4.46Å; R279-W378 VanDerWaalsContact NH2-NE1 3.14Å
280	C	97.7	Very high	97.7	Very high	62 Å²	62	64.4 Å²	64.4	42%	0.419	32%	0.319	S	S	.	.	H	α-helix	trans	-58	-43.7	175.1	-174.6	0	0	0	0	111.5	R276 T277 I282 D283 Q284	R276-C280 WeakPolarHBondContact O-CB 3.34Å; R276-C280 PolarHBondContact O-N 2.84Å; T277-C280 WeakPolarHBondContact O-CB 3.09Å; T277-C280 PolarHBondContact O-N 3.46Å; C280-I282 PolarHBondContact O-N 3.38Å; C280-D283 PolarHBondContact O-N 3.19Å; C280-Q284 VanDerWaalsContact O-CG 3.31Å; C280-Q284 WeakPolarHBondContact O-CG 3.24Å; C280-Q284 PolarHBondContact O-N 2.8Å; C280-Q284 PolarHBondContact SG-NE2 3.46Å; C280-Q284 VanDerWaalsContact SG-NE2 3.4Å
281	A	98.4	Very high	97.8	Very high	10 Å²	10	60 Å²	60	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-40.6	175.7	0	0	0	0	0	112.4	T277 R278 R279 A285 P362 L364	T277-A281 PolarHBondContact O-N 3.05Å; T277-A281 VanDerWaalsContact O-N 3.09Å; R278-A281 PolarHBondContact O-N 2.78Å; R279-A281 VanDerWaalsContact C-N 3.3Å; R279-A281 PolarHBondContact O-N 2.97Å; A281-A285 WeakPolarHBondContact O-CB 3.35Å; A281-A285 PolarHBondContact O-N 3.2Å; A281-P362 HydrophobicContact CB-CB 4.24Å; A281-L364 HydrophobicContact CB-CD2 3.77Å
282	I	98.4	Very high	97.8	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-47.1	173.7	-71.9	163.8	0	0	0	111.3	R278 R279 C280 Q284 A285 K286 L364 E368 V371 W378	R278-I282 WeakPolarHBondContact O-CG1 3.43Å; R278-I282 PolarHBondContact O-N 3.03Å; R279-I282 WeakPolarHBondContact O-CB 3.4Å; R279-I282 PolarHBondContact O-N 3.41Å; R279-I282 VanDerWaalsContact O-N 3.15Å; C280-I282 PolarHBondContact O-N 3.38Å; I282-Q284 VanDerWaalsContact C-N 3.32Å; I282-Q284 PolarHBondContact O-N 3.04Å; I282-A285 WeakPolarHBondContact O-CB 3.34Å; I282-A285 PolarHBondContact O-N 3.43Å; I282-A285 VanDerWaalsContact O-N 3.14Å; I282-K286 PolarHBondContact O-N 3.12Å; I282-K286 VanDerWaalsContact O-N 3.13Å; I282-L364 HydrophobicContact CG1-CD2 4.43Å; I282-E368 HydrophobicContact CD1-CB 3.94Å; I282-E368 HydrophobicContact CD1-CG 3.99Å; I282-E368 HydrophobicContact CG1-CB 3.82Å; I282-E368 HydrophobicContact CG1-CG 4.31Å; I282-V371 HydrophobicContact CD1-CB 4.31Å; I282-V371 HydrophobicContact CD1-CG1 4.18Å; I282-V371 HydrophobicContact CG2-CG1 4.32Å; I282-W378 HydrophobicContact CD1-CE3 3.56Å; I282-W378 HydrophobicContact CD1-CH2 4.48Å; I282-W378 HydrophobicContact CD1-CZ3 3.35Å
283	D	98	Very high	97.9	Very high	85 Å²	85	50.4 Å²	50.4	46%	0.455	25%	0.251	S	S	.	.	H	α-helix	trans	-66.7	-35.8	-177.4	-70.9	-30.4	0	0	0	111.9	R279 C280 K286	R279-D283 PolarHBondContact O-N 3.18Å; C280-D283 PolarHBondContact O-N 3.19Å; D283-K286 IonicContact OD1-NZ 3.07Å; D283-K286 PolarHBondContact OD1-NZ 3.2Å
284	Q	97.8	Very high	98	Very high	98 Å²	98	47.6 Å²	47.6	46%	0.458	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-44.6	170	-71.6	176.1	17.9	0	0	111.4	C280 I282 K286 C287 C288 P362	C280-Q284 VanDerWaalsContact O-CG 3.31Å; C280-Q284 WeakPolarHBondContact O-CG 3.24Å; C280-Q284 PolarHBondContact O-N 2.8Å; C280-Q284 PolarHBondContact SG-NE2 3.46Å; C280-Q284 VanDerWaalsContact SG-NE2 3.4Å; I282-Q284 VanDerWaalsContact C-N 3.32Å; I282-Q284 PolarHBondContact O-N 3.04Å; Q284-K286 VanDerWaalsContact C-N 3.3Å; Q284-K286 PolarHBondContact O-N 3.24Å; Q284-C287 PolarHBondContact O-N 2.77Å; Q284-C287 VanDerWaalsContact O-N 3.11Å; Q284-C288 PolarHBondContact O-SG 3.23Å; Q284-C288 VanDerWaalsContact O-SG 3.34Å; Q284-P362 HydrophobicContact CB-CG 3.61Å; Q284-P362 VanDerWaalsContact OE1-CG 3.31Å
285	A	98.3	Very high	98	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-31.4	-178.7	0	0	0	0	0	113.8	A281 I282 C287 C288 F291 L364	A281-A285 WeakPolarHBondContact O-CB 3.35Å; A281-A285 PolarHBondContact O-N 3.2Å; I282-A285 WeakPolarHBondContact O-CB 3.34Å; I282-A285 PolarHBondContact O-N 3.43Å; I282-A285 VanDerWaalsContact O-N 3.14Å; A285-C287 PolarHBondContact O-N 3.05Å; A285-C288 WeakPolarHBondContact O-CB 3.35Å; A285-C288 PolarHBondContact O-N 3.46Å; A285-C288 VanDerWaalsContact O-N 3.1Å; A285-F291 HydrophobicContact CB-CE1 4.44Å; A285-F291 WeakPolarHBondContact O-CZ 3.4Å; A285-L364 HydrophobicContact CB-CD1 3.58Å; A285-L364 HydrophobicContact CB-CG 4.45Å
286	K	97.8	Very high	98	Very high	93 Å²	93	46.7 Å²	46.7	40%	0.404	23%	0.231	S	C	.	.	H	α-helix	trans	-56.2	-35.4	174.3	-69.7	173.1	-175.7	161.8	0	112.4	I282 D283 Q284 S372	I282-K286 PolarHBondContact O-N 3.12Å; I282-K286 VanDerWaalsContact O-N 3.13Å; D283-K286 IonicContact OD1-NZ 3.07Å; D283-K286 PolarHBondContact OD1-NZ 3.2Å; Q284-K286 VanDerWaalsContact C-N 3.3Å; Q284-K286 PolarHBondContact O-N 3.24Å; K286-S372 WeakPolarHBondContact CG-OG 3.46Å; K286-S372 PolarHBondContact N-OG 3.43Å
287	C	96.9	Very high	97.9	Very high	115 Å²	115	41.4 Å²	41.4	78%	0.777	22%	0.218	S	C	*	.	H	α-helix	trans	-84.4	-12.8	-179.1	-62.1	0	0	0	0	113.8	Q284 A285	Q284-C287 PolarHBondContact O-N 2.77Å; Q284-C287 VanDerWaalsContact O-N 3.11Å; A285-C287 PolarHBondContact O-N 3.05Å
288	C	98.2	Very high	97.7	Very high	13 Å²	13	40.6 Å²	40.6	9%	0.088	21%	0.212	C	C	.	.			trans	-77.2	146.7	-179.5	-61.9	0	0	0	0	111.9	Q284 A285 F291 K319 E341 C342	Q284-C288 PolarHBondContact O-SG 3.23Å; Q284-C288 VanDerWaalsContact O-SG 3.34Å; A285-C288 WeakPolarHBondContact O-CB 3.35Å; A285-C288 PolarHBondContact O-N 3.46Å; A285-C288 VanDerWaalsContact O-N 3.1Å; C288-F291 HydrophobicContact CB-CE2 3.93Å; C288-F291 HydrophobicContact CB-CZ 3.87Å; C288-F291 WeakPolarHBondContact O-CE2 3.11Å; C288-K319 WeakPolarHBondContact O-CE 3.43Å; C288-K319 PolarHBondContact O-NZ 3.35Å; C288-E341 HydrophobicContact CB-CB 3.85Å; C288-C342 HydrophobicContact CB-CB 3.95Å
289	H	98.3	Very high	97.4	Very high	99 Å²	99	40.9 Å²	40.9	46%	0.458	22%	0.215	S	C	.	.			trans	-105.6	-39.8	172	-174.9	65.9	0	0	0	112.7	K318 K319 E320 E341	H289-K318 PolarHBondContact CE1-O 3.2Å; H289-K319 WeakPolarHBondContact O-CB 3.31Å; H289-E320 PolarHBondContact O-N 3.49Å; H289-E341 WeakPolarHBondContact CA-OE2 3.16Å; H289-E341 PolarHBondContact N-OE2 3.12Å
290	K	98.6	Very high	97.1	Very high	40 Å²	40	38.4 Å²	38.4	17%	0.174	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118	-175.7	-169.3	178.6	-77.5	174.6	0	112	E320 F322 D339 I340 E341 C342	K290-E320 WeakPolarHBondContact CA-O 3.49Å; K290-E320 HydrophobicContact CB-CB 4.48Å; K290-E320 WeakPolarHBondContact CE-OE1 3.41Å; K290-E320 WeakPolarHBondContact CE-OE2 3.21Å; K290-E320 HydrophobicContact CG-CB 4.32Å; K290-E320 HydrophobicContact CG-CG 4.46Å; K290-E320 IonicContact NZ-OE1 3.95Å; K290-E320 IonicContact NZ-OE2 3.77Å; K290-F322 HydrophobicContact CD-CD2 4.18Å; K290-F322 HydrophobicContact CD-CE2 3.61Å; K290-F322 HydrophobicContact CG-CD2 3.96Å; K290-F322 HydrophobicContact CG-CE2 3.71Å; K290-D339 HydrophobicContact CD-CB 4.06Å; K290-D339 WeakPolarHBondContact CD-O 3.47Å; K290-I340 HydrophobicContact CD-CD1 4.09Å; K290-I340 HydrophobicContact CG-CD1 4.01Å; K290-E341 HydrophobicContact CB-CG 4.46Å; K290-E341 PolarHBondContact N-OE2 3.48Å; K290-E341 PolarHBondContact O-N 3.39Å; K290-C342 PolarHBondContact O-N 3.36Å
291	F	98.8	Very high	96.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.2	-174.9	-73.3	-103.1	0	0	0	112.2	A285 C288 L314 K319 E320 V321 F322 C342 V344 L369	A285-F291 HydrophobicContact CB-CE1 4.44Å; A285-F291 WeakPolarHBondContact O-CZ 3.4Å; C288-F291 HydrophobicContact CB-CE2 3.93Å; C288-F291 HydrophobicContact CB-CZ 3.87Å; C288-F291 WeakPolarHBondContact O-CE2 3.11Å; F291-L314 HydrophobicContact CB-CD1 3.91Å; F291-L314 HydrophobicContact CB-CD2 4.42Å; F291-L314 HydrophobicContact CD1-CD1 4.17Å; F291-L314 HydrophobicContact CD1-CD2 3.84Å; F291-L314 HydrophobicContact CD2-CD2 3.72Å; F291-L314 HydrophobicContact CE1-CD2 3.94Å; F291-L314 HydrophobicContact CE2-CD2 3.83Å; F291-L314 HydrophobicContact CG-CD1 4.03Å; F291-L314 HydrophobicContact CG-CD2 3.73Å; F291-L314 HydrophobicContact CZ-CD2 3.94Å; F291-K319 HydrophobicContact CD2-CB 3.94Å; F291-K319 HydrophobicContact CD2-CG 4.25Å; F291-K319 HydrophobicContact CE2-CB 4.13Å; F291-K319 HydrophobicContact CE2-CD 3.9Å; F291-K319 HydrophobicContact CE2-CG 3.92Å; F291-E320 PolarHBondContact N-O 3.23Å; F291-V321 WeakPolarHBondContact O-CA 3.21Å; F291-F322 PolarHBondContact O-N 2.91Å; F291-C342 WeakPolarHBondContact CA-O 3.48Å; F291-C342 HydrophobicContact CD1-CB 3.69Å; F291-C342 HydrophobicContact CE1-CB 3.6Å; F291-C342 HydrophobicContact CG-CB 4.4Å; F291-C342 HydrophobicContact CZ-CB 4.23Å; F291-V344 HydrophobicContact CD1-CG2 4.13Å; F291-L369 HydrophobicContact CD1-CD1 4.41Å; F291-L369 HydrophobicContact CE1-CD1 3.99Å
292	G	98.7	Very high	96.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116	166.9	0	0	0	0	0	110.5	F322 C342 W343 V344	G292-F322 CarbonylContact C-O 3.52Å; G292-F322 WeakPolarHBondContact CA-O 3.28Å; G292-C342 PolarHBondContact N-O 3.4Å; G292-W343 CarbonylContact O-C 3.59Å; G292-W343 WeakPolarHBondContact O-CA 3.31Å; G292-V344 PolarHBondContact O-N 2.97Å
293	I	98.8	Very high	96.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.1	171.6	-55.2	175.1	0	0	0	108.5	V307 L310 K311 L314 V321 F322 L323 F324 V344 V346	I293-V307 HydrophobicContact CG2-CG1 4.12Å; I293-V307 HydrophobicContact CG2-CG2 4.15Å; I293-L310 HydrophobicContact CD1-CB 4.04Å; I293-K311 HydrophobicContact CD1-CB 3.95Å; I293-L314 HydrophobicContact CD1-CD1 3.95Å; I293-L314 HydrophobicContact CG1-CD1 4.15Å; I293-V321 HydrophobicContact CD1-CG1 3.53Å; I293-V321 HydrophobicContact CG1-CG1 3.86Å; I293-F322 PolarHBondContact N-O 3.3Å; I293-L323 HydrophobicContact CB-CD2 3.81Å; I293-L323 HydrophobicContact CD1-CD2 4.07Å; I293-L323 HydrophobicContact CG1-CD2 4.37Å; I293-L323 HydrophobicContact CG2-CD2 4.38Å; I293-L323 WeakPolarHBondContact O-CA 3.44Å; I293-F324 PolarHBondContact O-N 3.17Å; I293-V344 CarbonylContact C-O 3.55Å; I293-V344 WeakPolarHBondContact CA-O 3.4Å; I293-V346 HydrophobicContact CG2-CG2 4.39Å
294	I	98.7	Very high	96.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	121	178.7	-54.2	163.7	0	0	0	108.9	F324 L326 I329 L334 W343 V344 Q345 V346 L363	I294-F324 CarbonylContact C-O 3.58Å; I294-F324 WeakPolarHBondContact CA-O 3.49Å; I294-F324 HydrophobicContact CG1-CB 4.31Å; I294-L326 HydrophobicContact CD1-CD1 4.4Å; I294-L326 HydrophobicContact CG2-CB 3.97Å; I294-L326 HydrophobicContact CG2-CD1 4.04Å; I294-L326 HydrophobicContact CG2-CG 4.19Å; I294-I329 HydrophobicContact CB-CD1 4.35Å; I294-I329 HydrophobicContact CD1-CD1 4.39Å; I294-I329 HydrophobicContact CD1-CG2 4.14Å; I294-I329 HydrophobicContact CG2-CD1 3.68Å; I294-I329 HydrophobicContact CG2-CG1 3.96Å; I294-L334 HydrophobicContact CD1-CD1 3.85Å; I294-L334 HydrophobicContact CD1-CD2 3.79Å; I294-L334 HydrophobicContact CD1-CG 4.49Å; I294-W343 HydrophobicContact CD1-CB 4.48Å; I294-W343 HydrophobicContact CD1-CD2 4.35Å; I294-W343 HydrophobicContact CD1-CE3 3.76Å; I294-W343 HydrophobicContact CD1-CZ3 4.37Å; I294-W343 HydrophobicContact CG1-CE3 3.83Å; I294-W343 HydrophobicContact CG1-CZ3 4.18Å; I294-V344 PolarHBondContact N-O 3.21Å; I294-Q345 HydrophobicContact CB-CB 4.35Å; I294-V346 PolarHBondContact O-N 3.42Å; I294-L363 HydrophobicContact CD1-CD1 4.33Å
295	L	98.2	Very high	96.2	Very high	30 Å²	30	36 Å²	36	16%	0.157	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	118.2	164.2	-177.6	76.1	0	0	0	108.5	T297 N303 V307 F324 L325 L326	L295-T297 PolarHBondContact O-N 3.12Å; L295-N303 VanDerWaalsContact CD1-N 3.33Å; L295-V307 HydrophobicContact CB-CG2 4.08Å; L295-V307 HydrophobicContact CD1-CG2 3.56Å; L295-V307 HydrophobicContact CG-CG2 4.4Å; L295-F324 PolarHBondContact N-O 3.45Å; L295-L325 HydrophobicContact CB-CD2 3.65Å; L295-L325 HydrophobicContact CD2-CD2 3.6Å; L295-L325 HydrophobicContact CG-CD2 4.15Å; L295-L326 PolarHBondContact O-N 2.92Å
296	G	97	Very high	96.2	Very high	3 Å²	3	36.1 Å²	36.1	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	119	175.4	0	0	0	0	0	111.8	G302 L326 V346	G296-G302 VanDerWaalsContact O-CA 3.28Å; G296-G302 WeakPolarHBondContact O-CA 3.3Å; G296-G302 PolarHBondContact O-N 3.38Å; G296-L326 CarbonylContact C-O 3.6Å; G296-L326 WeakPolarHBondContact CA-O 3.32Å; G296-V346 PolarHBondContact N-O 3.48Å
297	T	94.8	Very high	96.2	Very high	61 Å²	61	32.2 Å²	32.2	37%	0.374	19%	0.194	S	C	.	.			trans	-99.7	2.5	-178.8	62.4	0	0	0	0	113.9	L295 G299 L325 L326 A327	L295-T297 PolarHBondContact O-N 3.12Å; T297-G299 PolarHBondContact O-N 2.89Å; T297-L325 HydrophobicContact CG2-CB 3.89Å; T297-L325 HydrophobicContact CG2-CD2 4.23Å; T297-L325 HydrophobicContact CG2-CG 4.46Å; T297-L326 PolarHBondContact N-O 3.21Å; T297-L326 VanDerWaalsContact OG1-C 3.25Å; T297-L326 PolarHBondContact OG1-O 2.88Å; T297-A327 WeakPolarHBondContact OG1-CA 3.25Å; T297-A327 PolarHBondContact OG1-N 3.1Å; T297-A327 VanDerWaalsContact OG1-N 3.12Å
298	L	93.3	Very high	96.3	Very high	23 Å²	23	31.6 Å²	31.6	12%	0.12	18%	0.183	C	C	.	.	S	Bend	trans	-71.2	101.7	172.6	-174	62.9	0	0	0	109.6	Y114 C118 R300 Q301 A327	Y114-L298 HydrophobicContact CD2-CD2 3.61Å; Y114-L298 HydrophobicContact CE2-CD2 3.71Å; C118-L298 HydrophobicContact CB-CG 4.28Å; L298-R300 PolarHBondContact O-N 3.41Å; L298-Q301 WeakPolarHBondContact O-CG 3.44Å; L298-Q301 PolarHBondContact O-N 3.12Å; L298-A327 WeakPolarHBondContact CB-O 3.36Å
299	G	91.7	Very high	96.3	Very high	7 Å²	7	31.7 Å²	31.7	7%	0.072	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	-113.9	-169.5	0	0	0	0	0	112.3	V119 T297	V119-G299 WeakPolarHBondContact O-CA 3.36Å; T297-G299 PolarHBondContact O-N 2.89Å
300	R	90.9	Very high	96.3	Very high	64 Å²	64	27 Å²	27	24%	0.242	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	29.1	-173.9	-62.2	-67.7	-174	174.3	1	112	C117 D121 I141 L143 L298 G302	C117-R300 CarbonylContact O-C 3.59Å; C117-R300 WeakPolarHBondContact O-CA 3.3Å; C117-R300 PolarHBondContact O-N 3.49Å; D121-R300 IonicContact OD1-CZ 3.56Å; D121-R300 VanDerWaalsContact OD1-CZ 3.27Å; D121-R300 IonicContact OD1-NE 2.67Å; D121-R300 PolarHBondContact OD1-NE 2.94Å; D121-R300 IonicContact OD1-NH2 2.67Å; D121-R300 PolarHBondContact OD1-NH2 3.5Å; D121-R300 IonicContact OD2-CZ 3.03Å; D121-R300 IonicContact OD2-NE 3.23Å; D121-R300 PolarHBondContact OD2-NE 3.38Å; D121-R300 IonicContact OD2-NH2 2.96Å; D121-R300 PolarHBondContact OD2-NH2 3.24Å; I141-R300 HydrophobicContact CD1-CB 3.34Å; I141-R300 HydrophobicContact CD1-CG 4.46Å; I141-R300 WeakPolarHBondContact CD1-O 3.49Å; I141-R300 HydrophobicContact CG2-CB 4.12Å; I141-R300 HydrophobicContact CG2-CG 4.4Å; L143-R300 HydrophobicContact CD2-CG 4.43Å; L298-R300 PolarHBondContact O-N 3.41Å; R300-G302 VanDerWaalsContact C-N 3.32Å
301	Q	92.1	Very high	96.3	Very high	10 Å²	10	28.1 Å²	28.1	5%	0.047	17%	0.166	C	C	.	.			trans	-63.2	-37.5	174.2	-73.8	-174.1	2.6	0	0	112.7	C117 C118 L298 A347	C117-Q301 HydrophobicContact CB-CG 3.78Å; C117-Q301 PolarHBondContact O-N 2.67Å; C117-Q301 VanDerWaalsContact SG-CG 3.57Å; C118-Q301 PolarHBondContact SG-NE2 3.14Å; L298-Q301 WeakPolarHBondContact O-CG 3.44Å; L298-Q301 PolarHBondContact O-N 3.12Å; Q301-A347 HydrophobicContact CB-CB 4.46Å
302	G	93.5	Very high	96.3	Very high	18 Å²	18	34.2 Å²	34.2	19%	0.186	19%	0.189	C	C	.	.			trans	-78.3	153.7	177.3	0	0	0	0	0	113.6	G296 R300 V346	G296-G302 VanDerWaalsContact O-CA 3.28Å; G296-G302 WeakPolarHBondContact O-CA 3.3Å; G296-G302 PolarHBondContact O-N 3.38Å; R300-G302 VanDerWaalsContact C-N 3.32Å; G302-V346 VanDerWaalsContact CA-O 3.25Å; G302-V346 WeakPolarHBondContact CA-O 3.44Å
303	N	94.4	Very high	96.2	Very high	33 Å²	33	35.9 Å²	35.9	18%	0.176	20%	0.196	C	C	.	.			trans	-138.5	111.5	177.1	-176.1	-28.2	0	0	0	110.2	L295 A305 I306 V307 V346 N397	L295-N303 VanDerWaalsContact CD1-N 3.33Å; N303-A305 VanDerWaalsContact C-N 3.26Å; N303-A305 PolarHBondContact O-N 3.15Å; N303-A305 WeakPolarHBondContact OD1-CB 3.36Å; N303-A305 PolarHBondContact OD1-N 3.31Å; N303-I306 HydrophobicContact CB-CB 4.26Å; N303-I306 HydrophobicContact CB-CD1 3.75Å; N303-I306 HydrophobicContact CB-CG1 3.99Å; N303-I306 PolarHBondContact O-N 3.3Å; N303-I306 VanDerWaalsContact O-N 3.08Å; N303-I306 PolarHBondContact OD1-N 3.18Å; N303-V307 PolarHBondContact O-N 3.09Å; N303-V346 HydrophobicContact CB-CG1 4.27Å; N303-N397 WeakPolarHBondContact CB-OD1 3.39Å; N303-N397 PolarHBondContact ND2-OD1 2.75Å
304	C	95.2	Very high	96.2	Very high	79 Å²	79	35.9 Å²	35.9	53%	0.534	20%	0.196	S	C	.	.	H	α-helix	trans	-59.2	-36	-177.9	-58.2	0	0	0	0	112.5	I306 V307 D308	C304-I306 VanDerWaalsContact C-N 3.27Å; C304-I306 PolarHBondContact O-N 3.13Å; C304-V307 PolarHBondContact O-N 3.01Å; C304-V307 VanDerWaalsContact O-N 3.14Å; C304-D308 WeakPolarHBondContact O-CB 3.39Å; C304-D308 VanDerWaalsContact O-CG 3.25Å; C304-D308 PolarHBondContact O-N 3.23Å
305	A	95.7	Very high	96.2	Very high	69 Å²	69	40.3 Å²	40.3	57%	0.57	22%	0.217	S	C	*	.	H	α-helix	trans	-65	-33.6	178.8	0	0	0	0	0	112.2	N303 L309	N303-A305 VanDerWaalsContact C-N 3.26Å; N303-A305 PolarHBondContact O-N 3.15Å; N303-A305 WeakPolarHBondContact OD1-CB 3.36Å; N303-A305 PolarHBondContact OD1-N 3.31Å; A305-L309 WeakPolarHBondContact O-CB 3.48Å; A305-L309 PolarHBondContact O-N 3.22Å; A305-L309 VanDerWaalsContact O-N 3.1Å
306	I	97.8	Very high	96.2	Very high	2 Å²	2	44 Å²	44	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-71	-44.6	173.1	-60.7	172.3	0	0	0	109.4	N303 C304 D308 L309 L310 V346 P366 Y386	N303-I306 HydrophobicContact CB-CB 4.26Å; N303-I306 HydrophobicContact CB-CD1 3.75Å; N303-I306 HydrophobicContact CB-CG1 3.99Å; N303-I306 PolarHBondContact O-N 3.3Å; N303-I306 VanDerWaalsContact O-N 3.08Å; N303-I306 PolarHBondContact OD1-N 3.18Å; C304-I306 VanDerWaalsContact C-N 3.27Å; C304-I306 PolarHBondContact O-N 3.13Å; I306-D308 VanDerWaalsContact C-N 3.33Å; I306-D308 PolarHBondContact O-N 3.06Å; I306-L309 WeakPolarHBondContact O-CB 3.37Å; I306-L309 PolarHBondContact O-N 3.3Å; I306-L310 HydrophobicContact CG2-CD1 3.98Å; I306-L310 HydrophobicContact CG2-CG 4.15Å; I306-L310 VanDerWaalsContact O-CG 3.27Å; I306-L310 WeakPolarHBondContact O-CG 3.26Å; I306-L310 PolarHBondContact O-N 3.13Å; I306-V346 HydrophobicContact CB-CG1 3.88Å; I306-V346 HydrophobicContact CD1-CG1 4.34Å; I306-V346 HydrophobicContact CG2-CG1 3.88Å; I306-V346 HydrophobicContact CG2-CG2 3.88Å; I306-P366 HydrophobicContact CG2-CB 4.02Å; I306-P366 HydrophobicContact CG2-CG 4.09Å; I306-Y386 HydrophobicContact CD1-CE2 4.35Å
307	V	98.5	Very high	96.2	Very high	11 Å²	11	48.4 Å²	48.4	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-56.6	-46.6	175.6	170.9	0	0	0	0	111.7	I293 L295 N303 C304 L309 L310 K311 L323 V346	I293-V307 HydrophobicContact CG2-CG1 4.12Å; I293-V307 HydrophobicContact CG2-CG2 4.15Å; L295-V307 HydrophobicContact CB-CG2 4.08Å; L295-V307 HydrophobicContact CD1-CG2 3.56Å; L295-V307 HydrophobicContact CG-CG2 4.4Å; N303-V307 PolarHBondContact O-N 3.09Å; C304-V307 PolarHBondContact O-N 3.01Å; C304-V307 VanDerWaalsContact O-N 3.14Å; V307-L309 VanDerWaalsContact C-N 3.32Å; V307-L309 PolarHBondContact O-N 2.85Å; V307-L310 PolarHBondContact O-N 3.09Å; V307-K311 WeakPolarHBondContact O-CB 3.31Å; V307-K311 PolarHBondContact O-N 3.47Å; V307-L323 HydrophobicContact CG1-CD1 4.46Å; V307-L323 HydrophobicContact CG1-CD2 3.9Å; V307-V346 HydrophobicContact CG2-CB 3.95Å; V307-V346 HydrophobicContact CG2-CG1 4.32Å; V307-V346 HydrophobicContact CG2-CG2 3.69Å
308	D	98.2	Very high	96.3	Very high	101 Å²	101	54.1 Å²	54.1	54%	0.54	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-40.2	178.1	-68.8	-25.8	0	0	0	111.8	C304 I306 R312	C304-D308 WeakPolarHBondContact O-CB 3.39Å; C304-D308 VanDerWaalsContact O-CG 3.25Å; C304-D308 PolarHBondContact O-N 3.23Å; I306-D308 VanDerWaalsContact C-N 3.33Å; I306-D308 PolarHBondContact O-N 3.06Å; D308-R312 VanDerWaalsContact O-CB 3.29Å; D308-R312 WeakPolarHBondContact O-CB 3.33Å; D308-R312 PolarHBondContact O-N 3.1Å; D308-R312 VanDerWaalsContact O-N 3.09Å
309	L	98.2	Very high	96.5	Very high	15 Å²	15	55.2 Å²	55.2	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-52.3	173.1	171.7	68.2	0	0	0	111.4	A305 I306 V307 R312 K313 P394	A305-L309 WeakPolarHBondContact O-CB 3.48Å; A305-L309 PolarHBondContact O-N 3.22Å; A305-L309 VanDerWaalsContact O-N 3.1Å; I306-L309 WeakPolarHBondContact O-CB 3.37Å; I306-L309 PolarHBondContact O-N 3.3Å; V307-L309 VanDerWaalsContact C-N 3.32Å; V307-L309 PolarHBondContact O-N 2.85Å; L309-R312 PolarHBondContact O-N 3.29Å; L309-K313 HydrophobicContact CD1-CG 4.22Å; L309-K313 WeakPolarHBondContact O-CG 3.43Å; L309-K313 PolarHBondContact O-N 2.87Å; L309-P394 HydrophobicContact CD2-CB 3.88Å; L309-P394 HydrophobicContact CD2-CG 3.91Å; L309-P394 WeakPolarHBondContact CD2-O 3.42Å
310	L	98.6	Very high	96.9	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.6	-42.4	-175.9	-60	176.3	0	0	0	111.4	I293 I306 V307 K313 L314 V344 V346 P366 L369 M370	I293-L310 HydrophobicContact CD1-CB 4.04Å; I306-L310 HydrophobicContact CG2-CD1 3.98Å; I306-L310 HydrophobicContact CG2-CG 4.15Å; I306-L310 VanDerWaalsContact O-CG 3.27Å; I306-L310 WeakPolarHBondContact O-CG 3.26Å; I306-L310 PolarHBondContact O-N 3.13Å; V307-L310 PolarHBondContact O-N 3.09Å; L310-K313 PolarHBondContact O-N 2.74Å; L310-L314 PolarHBondContact O-N 3.23Å; L310-V344 HydrophobicContact CD1-CG1 3.9Å; L310-V346 HydrophobicContact CD1-CG2 3.56Å; L310-P366 HydrophobicContact CD1-CB 4.01Å; L310-P366 HydrophobicContact CD1-CG 4.2Å; L310-P366 HydrophobicContact CD2-CB 4.16Å; L310-L369 HydrophobicContact CB-CD2 3.91Å; L310-L369 HydrophobicContact CD1-CD2 4.49Å; L310-L369 HydrophobicContact CD2-CD2 3.8Å; L310-L369 HydrophobicContact CG-CD2 4.23Å; L310-M370 HydrophobicContact CD2-CG 4.31Å; L310-M370 HydrophobicContact CD2-SD 4.22Å
311	K	98.6	Very high	97.2	Very high	64 Å²	64	56.7 Å²	56.7	28%	0.278	29%	0.287	S	S	.	.	H	α-helix	trans	-57	-52.3	175.5	-179.2	176.2	-174.5	-71.9	0	110.8	I293 V307 K313 L314 E315 V321 L323	I293-K311 HydrophobicContact CD1-CB 3.95Å; V307-K311 WeakPolarHBondContact O-CB 3.31Å; V307-K311 PolarHBondContact O-N 3.47Å; K311-K313 VanDerWaalsContact C-N 3.33Å; K311-K313 PolarHBondContact O-N 2.9Å; K311-L314 PolarHBondContact O-N 2.9Å; K311-E315 WeakPolarHBondContact CE-OE1 3.43Å; K311-E315 HydrophobicContact CG-CG 4.45Å; K311-E315 IonicContact NZ-OE1 2.67Å; K311-E315 PolarHBondContact NZ-OE1 2.99Å; K311-E315 IonicContact NZ-OE2 2.65Å; K311-E315 PolarHBondContact NZ-OE2 3.42Å; K311-E315 WeakPolarHBondContact O-CB 3.23Å; K311-E315 WeakPolarHBondContact O-CG 3.45Å; K311-E315 PolarHBondContact O-N 3.07Å; K311-V321 HydrophobicContact CG-CG1 4.26Å; K311-L323 HydrophobicContact CD-CD1 4.1Å; K311-L323 HydrophobicContact CD-CD2 4.25Å; K311-L323 HydrophobicContact CD-CG 4.44Å
312	R	98.5	Very high	97.5	Very high	129 Å²	129	60.1 Å²	60.1	49%	0.487	30%	0.302	S	S	.	.	H	α-helix	trans	-57.4	-44.1	177.5	172.7	172.3	51.1	122.9	-2.9	112.1	D308 L309 E315 E316	D308-R312 VanDerWaalsContact O-CB 3.29Å; D308-R312 WeakPolarHBondContact O-CB 3.33Å; D308-R312 PolarHBondContact O-N 3.1Å; D308-R312 VanDerWaalsContact O-N 3.09Å; L309-R312 PolarHBondContact O-N 3.29Å; R312-E315 PolarHBondContact O-N 3.45Å; R312-E316 HydrophobicContact CG-CG 4.41Å; R312-E316 VanDerWaalsContact CG-OE1 3.26Å; R312-E316 WeakPolarHBondContact CG-OE1 3.47Å; R312-E316 WeakPolarHBondContact O-CB 3.22Å; R312-E316 VanDerWaalsContact O-CG 3.28Å; R312-E316 WeakPolarHBondContact O-CG 3.48Å; R312-E316 PolarHBondContact O-N 2.68Å
313	K	98.4	Very high	97.7	Very high	34 Å²	34	63.6 Å²	63.6	15%	0.148	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-37.5	179.1	-71.8	-57.8	-176.9	-177.5	0	113.7	L309 L310 K311 E316 M317 M370 L373 Q375	L309-K313 HydrophobicContact CD1-CG 4.22Å; L309-K313 WeakPolarHBondContact O-CG 3.43Å; L309-K313 PolarHBondContact O-N 2.87Å; L310-K313 PolarHBondContact O-N 2.74Å; K311-K313 VanDerWaalsContact C-N 3.33Å; K311-K313 PolarHBondContact O-N 2.9Å; K313-E316 VanDerWaalsContact CD-OE2 3.3Å; K313-E316 WeakPolarHBondContact CD-OE2 3.47Å; K313-E316 IonicContact NZ-OE2 3.31Å; K313-E316 PolarHBondContact NZ-OE2 3.02Å; K313-M317 WeakPolarHBondContact O-CG 3.47Å; K313-M317 PolarHBondContact O-N 3.05Å; K313-M370 HydrophobicContact CG-CE 4.36Å; K313-M370 HydrophobicContact CG-SD 4.15Å; K313-L373 HydrophobicContact CB-CD1 3.89Å; K313-Q375 HydrophobicContact CD-CG 4.23Å; K313-Q375 VanDerWaalsContact CE-OE1 3.28Å
314	L	98.6	Very high	97.9	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-69.1	-41.6	173.9	-79.1	165.4	0	0	0	112	F291 I293 L310 K311 M317 K318 K319 V321 L369 L373	F291-L314 HydrophobicContact CB-CD1 3.91Å; F291-L314 HydrophobicContact CB-CD2 4.42Å; F291-L314 HydrophobicContact CD1-CD1 4.17Å; F291-L314 HydrophobicContact CD1-CD2 3.84Å; F291-L314 HydrophobicContact CD2-CD2 3.72Å; F291-L314 HydrophobicContact CE1-CD2 3.94Å; F291-L314 HydrophobicContact CE2-CD2 3.83Å; F291-L314 HydrophobicContact CG-CD1 4.03Å; F291-L314 HydrophobicContact CG-CD2 3.73Å; F291-L314 HydrophobicContact CZ-CD2 3.94Å; I293-L314 HydrophobicContact CD1-CD1 3.95Å; I293-L314 HydrophobicContact CG1-CD1 4.15Å; L310-L314 PolarHBondContact O-N 3.23Å; K311-L314 PolarHBondContact O-N 2.9Å; L314-M317 CarbonylContact O-C 3.44Å; L314-M317 WeakPolarHBondContact O-CA 3.49Å; L314-M317 WeakPolarHBondContact O-CB 3.25Å; L314-M317 PolarHBondContact O-N 3.18Å; L314-M317 VanDerWaalsContact O-N 3.14Å; L314-K318 PolarHBondContact O-N 3Å; L314-K319 HydrophobicContact CB-CB 4.22Å; L314-K319 HydrophobicContact CD2-CB 3.99Å; L314-K319 HydrophobicContact CD2-CG 3.87Å; L314-K319 WeakPolarHBondContact O-CB 3.49Å; L314-K319 PolarHBondContact O-N 3.33Å; L314-V321 HydrophobicContact CB-CG2 3.46Å; L314-V321 VanDerWaalsContact CB-CG2 3.46Å; L314-V321 HydrophobicContact CD1-CG1 4.43Å; L314-V321 HydrophobicContact CD1-CG2 4.07Å; L314-V321 HydrophobicContact CG-CG2 4.36Å; L314-L369 HydrophobicContact CD1-CD2 3.86Å; L314-L369 HydrophobicContact CD2-CD1 4.03Å; L314-L369 HydrophobicContact CG-CD1 4.43Å; L314-L369 HydrophobicContact CG-CD2 4.05Å; L314-L373 HydrophobicContact CD2-CD1 4.19Å; L314-L373 HydrophobicContact CD2-CD2 4.21Å; L314-L373 HydrophobicContact CG-CD1 4.24Å
315	E	98.1	Very high	98	Very high	94 Å²	94	65.9 Å²	65.9	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-39.5	177.4	-71.8	172.6	161.1	0	0	112.3	K311 R312 M317 K318 V321	K311-E315 WeakPolarHBondContact CE-OE1 3.43Å; K311-E315 HydrophobicContact CG-CG 4.45Å; K311-E315 IonicContact NZ-OE1 2.67Å; K311-E315 PolarHBondContact NZ-OE1 2.99Å; K311-E315 IonicContact NZ-OE2 2.65Å; K311-E315 PolarHBondContact NZ-OE2 3.42Å; K311-E315 WeakPolarHBondContact O-CB 3.23Å; K311-E315 WeakPolarHBondContact O-CG 3.45Å; K311-E315 PolarHBondContact O-N 3.07Å; R312-E315 PolarHBondContact O-N 3.45Å; E315-M317 PolarHBondContact O-N 2.79Å; E315-K318 WeakPolarHBondContact O-CA 3.41Å; E315-K318 PolarHBondContact O-N 3.34Å; E315-V321 HydrophobicContact CG-CG2 4.26Å
316	E	97.8	Very high	98	Very high	107 Å²	107	64.2 Å²	64.2	50%	0.5	30%	0.302	S	S	.	.	H	α-helix	trans	-55.2	-33.9	170.9	-78.4	170.2	-164.6	0	0	111.5	R312 K313 K318	R312-E316 HydrophobicContact CG-CG 4.41Å; R312-E316 VanDerWaalsContact CG-OE1 3.26Å; R312-E316 WeakPolarHBondContact CG-OE1 3.47Å; R312-E316 WeakPolarHBondContact O-CB 3.22Å; R312-E316 VanDerWaalsContact O-CG 3.28Å; R312-E316 WeakPolarHBondContact O-CG 3.48Å; R312-E316 PolarHBondContact O-N 2.68Å; K313-E316 VanDerWaalsContact CD-OE2 3.3Å; K313-E316 WeakPolarHBondContact CD-OE2 3.47Å; K313-E316 IonicContact NZ-OE2 3.31Å; K313-E316 PolarHBondContact NZ-OE2 3.02Å; E316-K318 VanDerWaalsContact C-N 3.3Å
317	M	96.9	Very high	97.9	Very high	96 Å²	96	66.5 Å²	66.5	47%	0.473	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	11.3	177.5	-67	-72.2	-69	0	0	113.5	K313 L314 E315 K319 L373	K313-M317 WeakPolarHBondContact O-CG 3.47Å; K313-M317 PolarHBondContact O-N 3.05Å; L314-M317 CarbonylContact O-C 3.44Å; L314-M317 WeakPolarHBondContact O-CA 3.49Å; L314-M317 WeakPolarHBondContact O-CB 3.25Å; L314-M317 PolarHBondContact O-N 3.18Å; L314-M317 VanDerWaalsContact O-N 3.14Å; E315-M317 PolarHBondContact O-N 2.79Å; M317-K319 HydrophobicContact CB-CG 4.12Å; M317-K319 PolarHBondContact O-N 3.14Å; M317-L373 HydrophobicContact CG-CD2 4.22Å
318	K	97.4	Very high	97.6	Very high	181 Å²	181	71 Å²	71	79%	0.787	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	33.7	-179.2	-54.1	179.3	-179.7	178.2	0	113.5	H289 L314 E315 E316	H289-K318 PolarHBondContact CE1-O 3.2Å; L314-K318 PolarHBondContact O-N 3Å; E315-K318 WeakPolarHBondContact O-CA 3.41Å; E315-K318 PolarHBondContact O-N 3.34Å; E316-K318 VanDerWaalsContact C-N 3.3Å
319	K	98.2	Very high	97.5	Very high	45 Å²	45	67 Å²	67	20%	0.196	32%	0.32	C	S	.	.			trans	-86.4	150.9	172.3	-54.8	-61.8	-169.9	169.8	0	110	C288 H289 F291 L314 M317	C288-K319 WeakPolarHBondContact O-CE 3.43Å; C288-K319 PolarHBondContact O-NZ 3.35Å; H289-K319 WeakPolarHBondContact O-CB 3.31Å; F291-K319 HydrophobicContact CD2-CB 3.94Å; F291-K319 HydrophobicContact CD2-CG 4.25Å; F291-K319 HydrophobicContact CE2-CB 4.13Å; F291-K319 HydrophobicContact CE2-CD 3.9Å; F291-K319 HydrophobicContact CE2-CG 3.92Å; L314-K319 HydrophobicContact CB-CB 4.22Å; L314-K319 HydrophobicContact CD2-CB 3.99Å; L314-K319 HydrophobicContact CD2-CG 3.87Å; L314-K319 WeakPolarHBondContact O-CB 3.49Å; L314-K319 PolarHBondContact O-N 3.33Å; M317-K319 HydrophobicContact CB-CG 4.12Å; M317-K319 PolarHBondContact O-N 3.14Å
320	E	98.5	Very high	97.4	Very high	77 Å²	77	68.7 Å²	68.7	36%	0.36	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	130.1	173.2	-166.8	-177.3	170.5	0	0	109.2	H289 K290 F291 F322	H289-E320 PolarHBondContact O-N 3.49Å; K290-E320 WeakPolarHBondContact CA-O 3.49Å; K290-E320 HydrophobicContact CB-CB 4.48Å; K290-E320 WeakPolarHBondContact CE-OE1 3.41Å; K290-E320 WeakPolarHBondContact CE-OE2 3.21Å; K290-E320 HydrophobicContact CG-CB 4.32Å; K290-E320 HydrophobicContact CG-CG 4.46Å; K290-E320 IonicContact NZ-OE1 3.95Å; K290-E320 IonicContact NZ-OE2 3.77Å; F291-E320 PolarHBondContact N-O 3.23Å; E320-F322 HydrophobicContact CG-CE2 3.69Å; E320-F322 HydrophobicContact CG-CZ 4.24Å; E320-F322 WeakPolarHBondContact OE1-CE2 3.45Å; E320-F322 WeakPolarHBondContact OE1-CZ 3.45Å
321	V	98.6	Very high	97.3	Very high	25 Å²	25	69.9 Å²	69.9	15%	0.152	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	127.7	-170.3	-172.2	0	0	0	0	111.2	F291 I293 K311 L314 E315 L323	F291-V321 WeakPolarHBondContact O-CA 3.21Å; I293-V321 HydrophobicContact CD1-CG1 3.53Å; I293-V321 HydrophobicContact CG1-CG1 3.86Å; K311-V321 HydrophobicContact CG-CG1 4.26Å; L314-V321 HydrophobicContact CB-CG2 3.46Å; L314-V321 VanDerWaalsContact CB-CG2 3.46Å; L314-V321 HydrophobicContact CD1-CG1 4.43Å; L314-V321 HydrophobicContact CD1-CG2 4.07Å; L314-V321 HydrophobicContact CG-CG2 4.36Å; E315-V321 HydrophobicContact CG-CG2 4.26Å; V321-L323 HydrophobicContact CG1-CD2 4.4Å
322	F	98.4	Very high	97.1	Very high	83 Å²	83	73.3 Å²	73.3	36%	0.364	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	139.3	173.1	-65.7	-92.2	0	0	0	110	K290 F291 G292 I293 E320 F324 I340	K290-F322 HydrophobicContact CD-CD2 4.18Å; K290-F322 HydrophobicContact CD-CE2 3.61Å; K290-F322 HydrophobicContact CG-CD2 3.96Å; K290-F322 HydrophobicContact CG-CE2 3.71Å; F291-F322 PolarHBondContact O-N 2.91Å; G292-F322 CarbonylContact C-O 3.52Å; G292-F322 WeakPolarHBondContact CA-O 3.28Å; I293-F322 PolarHBondContact N-O 3.3Å; E320-F322 HydrophobicContact CG-CE2 3.69Å; E320-F322 HydrophobicContact CG-CZ 4.24Å; E320-F322 WeakPolarHBondContact OE1-CE2 3.45Å; E320-F322 WeakPolarHBondContact OE1-CZ 3.45Å; F322-F324 HydrophobicContact CB-CD2 4.34Å; F322-F324 HydrophobicContact CB-CE2 3.48Å; F322-F324 VanDerWaalsContact CB-CE2 3.48Å; F322-F324 HydrophobicContact CB-CZ 3.99Å; F322-I340 HydrophobicContact CB-CD1 4.07Å; F322-I340 HydrophobicContact CD2-CD1 3.63Å; F322-I340 HydrophobicContact CE2-CD1 4.4Å; F322-I340 HydrophobicContact CG-CD1 4.06Å
323	L	98.3	Very high	97	Very high	91 Å²	91	69.1 Å²	69.1	48%	0.476	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.8	178.9	-59.1	-175.3	0	0	0	110.5	I293 V307 K311 V321	I293-L323 HydrophobicContact CB-CD2 3.81Å; I293-L323 HydrophobicContact CD1-CD2 4.07Å; I293-L323 HydrophobicContact CG1-CD2 4.37Å; I293-L323 HydrophobicContact CG2-CD2 4.38Å; I293-L323 WeakPolarHBondContact O-CA 3.44Å; V307-L323 HydrophobicContact CG1-CD1 4.46Å; V307-L323 HydrophobicContact CG1-CD2 3.9Å; K311-L323 HydrophobicContact CD-CD1 4.1Å; K311-L323 HydrophobicContact CD-CD2 4.25Å; K311-L323 HydrophobicContact CD-CG 4.44Å; V321-L323 HydrophobicContact CG1-CD2 4.4Å
324	F	98.3	Very high	97	Very high	36 Å²	36	67.6 Å²	67.6	16%	0.158	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.5	-179.9	-62.9	-95.9	0	0	0	110.3	I293 I294 L295 F322 F337 I340 W343	I293-F324 PolarHBondContact O-N 3.17Å; I294-F324 CarbonylContact C-O 3.58Å; I294-F324 WeakPolarHBondContact CA-O 3.49Å; I294-F324 HydrophobicContact CG1-CB 4.31Å; L295-F324 PolarHBondContact N-O 3.45Å; F322-F324 HydrophobicContact CB-CD2 4.34Å; F322-F324 HydrophobicContact CB-CE2 3.48Å; F322-F324 VanDerWaalsContact CB-CE2 3.48Å; F322-F324 HydrophobicContact CB-CZ 3.99Å; F324-F337 HydrophobicContact CD1-CE2 4.31Å; F324-F337 HydrophobicContact CD1-CZ 4.25Å; F324-F337 AromaticContact CE1-CD1 3.87Å; F324-F337 HydrophobicContact CE1-CD1 3.87Å; F324-F337 HydrophobicContact CE1-CD2 4.09Å; F324-F337 AromaticContact CE1-CE1 3.7Å; F324-F337 HydrophobicContact CE1-CE1 3.7Å; F324-F337 AromaticContact CE1-CE2 3.92Å; F324-F337 HydrophobicContact CE1-CE2 3.92Å; F324-F337 HydrophobicContact CE1-CG 4.07Å; F324-F337 AromaticContact CE1-CZ 3.72Å; F324-F337 HydrophobicContact CE1-CZ 3.72Å; F324-F337 HydrophobicContact CZ-CD1 4.23Å; F324-F337 HydrophobicContact CZ-CE1 4.47Å; F324-F337 HydrophobicContact CZ-CG 4.32Å; F324-I340 HydrophobicContact CE2-CD1 4.14Å; F324-I340 HydrophobicContact CE2-CG1 4.35Å; F324-I340 HydrophobicContact CZ-CD1 4.2Å; F324-I340 HydrophobicContact CZ-CG1 4.17Å; F324-W343 HydrophobicContact CD1-CZ3 4.43Å; F324-W343 HydrophobicContact CD2-CH2 4.28Å; F324-W343 AromaticContact CD2-CZ3 3.57Å; F324-W343 HydrophobicContact CD2-CZ3 3.57Å; F324-W343 HydrophobicContact CE1-CH2 4.23Å; F324-W343 HydrophobicContact CE1-CZ3 4.43Å; F324-W343 AromaticContact CE2-CH2 3.91Å; F324-W343 HydrophobicContact CE2-CH2 3.91Å; F324-W343 AromaticContact CE2-CZ3 3.55Å; F324-W343 HydrophobicContact CE2-CZ3 3.55Å; F324-W343 HydrophobicContact CG-CZ3 4.02Å; F324-W343 AromaticContact CZ-CH2 3.89Å; F324-W343 HydrophobicContact CZ-CH2 3.89Å; F324-W343 HydrophobicContact CZ-CZ3 4.02Å
325	L	97.2	Very high	96.9	Very high	123 Å²	123	71.4 Å²	71.4	64%	0.644	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.6	171.6	-59.5	-172.9	0	0	0	108	L295 T297	L295-L325 HydrophobicContact CB-CD2 3.65Å; L295-L325 HydrophobicContact CD2-CD2 3.6Å; L295-L325 HydrophobicContact CG-CD2 4.15Å; T297-L325 HydrophobicContact CG2-CB 3.89Å; T297-L325 HydrophobicContact CG2-CD2 4.23Å; T297-L325 HydrophobicContact CG2-CG 4.46Å
326	L	96.1	Very high	96.9	Very high	34 Å²	34	73 Å²	73	18%	0.178	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.6	177.2	-67.2	175.5	0	0	0	110.1	I294 L295 G296 T297 I329 T333 L334	I294-L326 HydrophobicContact CD1-CD1 4.4Å; I294-L326 HydrophobicContact CG2-CB 3.97Å; I294-L326 HydrophobicContact CG2-CD1 4.04Å; I294-L326 HydrophobicContact CG2-CG 4.19Å; L295-L326 PolarHBondContact O-N 2.92Å; G296-L326 CarbonylContact C-O 3.6Å; G296-L326 WeakPolarHBondContact CA-O 3.32Å; T297-L326 PolarHBondContact N-O 3.21Å; T297-L326 VanDerWaalsContact OG1-C 3.25Å; T297-L326 PolarHBondContact OG1-O 2.88Å; L326-I329 HydrophobicContact CB-CG1 4.18Å; L326-I329 HydrophobicContact CD1-CG1 4.36Å; L326-T333 HydrophobicContact CD1-CG2 4.35Å; L326-T333 HydrophobicContact CD2-CG2 3.94Å; L326-L334 HydrophobicContact CD1-CD2 3.73Å
327	A	94	Very high	96.9	Very high	50 Å²	50	71.8 Å²	71.8	41%	0.413	36%	0.36	S	S	.	.	S	Bend	trans	-74	-51.2	170.9	0	0	0	0	0	110	T297 L298	T297-A327 WeakPolarHBondContact OG1-CA 3.25Å; T297-A327 PolarHBondContact OG1-N 3.1Å; T297-A327 VanDerWaalsContact OG1-N 3.12Å; L298-A327 WeakPolarHBondContact CB-O 3.36Å
328	E	94.1	Very high	96.8	Very high	106 Å²	106	71.4 Å²	71.4	50%	0.495	37%	0.367	S	S	.	.	S	Bend	trans	-117.2	128.1	176.4	-63.5	-168	-102.8	0	0	110.2	Y114	Y114-E328 PolarHBondContact OH-OE2 2.96Å
329	I	95.6	Very high	96.8	Very high	17 Å²	17	67.9 Å²	67.9	9%	0.087	36%	0.356	C	S	.	.			trans	-98	112	-178.4	-59.7	170.5	0	0	0	108.1	I294 L326 L334 Q345 A347 L351 F359 L363	I294-I329 HydrophobicContact CB-CD1 4.35Å; I294-I329 HydrophobicContact CD1-CD1 4.39Å; I294-I329 HydrophobicContact CD1-CG2 4.14Å; I294-I329 HydrophobicContact CG2-CD1 3.68Å; I294-I329 HydrophobicContact CG2-CG1 3.96Å; L326-I329 HydrophobicContact CB-CG1 4.18Å; L326-I329 HydrophobicContact CD1-CG1 4.36Å; I329-L334 HydrophobicContact CG2-CD1 4.01Å; I329-Q345 HydrophobicContact CD1-CB 3.79Å; I329-A347 HydrophobicContact CD1-CB 3.89Å; I329-L351 HydrophobicContact CB-CD1 4.14Å; I329-L351 HydrophobicContact CD1-CD1 3.85Å; I329-L351 HydrophobicContact CG1-CD1 4.36Å; I329-F359 HydrophobicContact CG2-CE1 4.03Å; I329-F359 HydrophobicContact CG2-CZ 4.07Å; I329-L363 HydrophobicContact CG2-CD2 4.48Å
330	N	95.1	Very high	96.8	Very high	50 Å²	50	66 Å²	66	27%	0.267	35%	0.348	S	S	.	.			trans	-130.2	153.6	179.6	61.4	70.2	0	0	0	112	E332 T333 L334	N330-E332 VanDerWaalsContact C-N 3.31Å; N330-E332 PolarHBondContact O-N 3.49Å; N330-E332 PolarHBondContact OD1-N 3.35Å; N330-E332 PolarHBondContact OD1-OE2 2.94Å; N330-T333 PolarHBondContact ND2-OG1 2.79Å; N330-T333 PolarHBondContact O-N 3.39Å; N330-T333 VanDerWaalsContact OD1-CB 3.3Å; N330-T333 WeakPolarHBondContact OD1-CB 3.28Å; N330-T333 PolarHBondContact OD1-N 2.97Å; N330-T333 PolarHBondContact OD1-OG1 2.91Å; N330-L334 PolarHBondContact O-N 2.75Å
331	P	96.2	Very high	96.8	Very high	26 Å²	26	66.5 Å²	66.5	17%	0.169	35%	0.351	C	S	.	.	H	α-helix	trans	-58.2	-38.8	-178.8	-26.3	35.9	0	0	0	114	T333 L334 N335 M358 F359	P331-T333 PolarHBondContact O-N 3.15Å; P331-L334 PolarHBondContact O-N 2.85Å; P331-N335 WeakPolarHBondContact O-CB 3.36Å; P331-N335 PolarHBondContact O-N 2.68Å; P331-N335 PolarHBondContact O-ND2 3.04Å; P331-N335 VanDerWaalsContact O-ND2 3.15Å; P331-M358 HydrophobicContact CG-CB 4.31Å; P331-M358 WeakPolarHBondContact CG-O 3.5Å; P331-F359 HydrophobicContact CB-CD1 4.32Å; P331-F359 HydrophobicContact CG-CD1 4.15Å; P331-F359 HydrophobicContact CG-CE1 4.05Å; P331-F359 HydrophobicContact CG-CG 4.49Å; P331-F359 HydrophobicContact CG-CZ 4.29Å
332	E	95.9	Very high	96.8	Very high	135 Å²	135	65.3 Å²	65.3	63%	0.631	34%	0.343	S	S	*	.	H	α-helix	trans	-59.2	-46.9	-177.4	-63.9	71.3	-158.6	0	0	111.1	N330 N335	N330-E332 VanDerWaalsContact C-N 3.31Å; N330-E332 PolarHBondContact O-N 3.49Å; N330-E332 PolarHBondContact OD1-N 3.35Å; N330-E332 PolarHBondContact OD1-OE2 2.94Å; E332-N335 PolarHBondContact O-N 2.77Å
333	T	96.6	Very high	96.8	Very high	41 Å²	41	61.4 Å²	61.4	25%	0.252	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-43.9	179.4	-56.3	0	0	0	0	111.3	L326 N330 P331 N335 I336	L326-T333 HydrophobicContact CD1-CG2 4.35Å; L326-T333 HydrophobicContact CD2-CG2 3.94Å; N330-T333 PolarHBondContact ND2-OG1 2.79Å; N330-T333 PolarHBondContact O-N 3.39Å; N330-T333 VanDerWaalsContact OD1-CB 3.3Å; N330-T333 WeakPolarHBondContact OD1-CB 3.28Å; N330-T333 PolarHBondContact OD1-N 2.97Å; N330-T333 PolarHBondContact OD1-OG1 2.91Å; P331-T333 PolarHBondContact O-N 3.15Å; T333-N335 PolarHBondContact O-N 3.45Å; T333-I336 PolarHBondContact O-N 2.93Å
334	L	97.6	Very high	96.8	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-71.2	-30.9	-177.7	-61.1	-166.2	0	0	0	112.8	I294 L326 I329 N330 P331 I336 F337 W343 F359 L363	I294-L334 HydrophobicContact CD1-CD1 3.85Å; I294-L334 HydrophobicContact CD1-CD2 3.79Å; I294-L334 HydrophobicContact CD1-CG 4.49Å; L326-L334 HydrophobicContact CD1-CD2 3.73Å; I329-L334 HydrophobicContact CG2-CD1 4.01Å; N330-L334 PolarHBondContact O-N 2.75Å; P331-L334 PolarHBondContact O-N 2.85Å; L334-I336 PolarHBondContact O-N 3.39Å; L334-F337 PolarHBondContact O-N 3.29Å; L334-W343 HydrophobicContact CB-CZ2 3.92Å; L334-W343 HydrophobicContact CD1-CB 4.41Å; L334-W343 HydrophobicContact CD1-CD2 3.89Å; L334-W343 HydrophobicContact CD1-CE3 4.45Å; L334-W343 HydrophobicContact CD1-CG 3.84Å; L334-W343 HydrophobicContact CD2-CD2 4.17Å; L334-W343 HydrophobicContact CD2-CE3 4.11Å; L334-W343 HydrophobicContact CD2-CH2 3.94Å; L334-W343 HydrophobicContact CD2-CZ2 3.99Å; L334-W343 HydrophobicContact CD2-CZ3 3.99Å; L334-W343 HydrophobicContact CG-CD2 4.42Å; L334-W343 HydrophobicContact CG-CZ2 4.4Å; L334-W343 WeakPolarHBondContact O-CZ2 3.3Å; L334-F359 HydrophobicContact CD1-CD1 3.73Å; L334-F359 HydrophobicContact CD1-CE1 3.67Å; L334-F359 HydrophobicContact CG-CE1 4.35Å; L334-L363 HydrophobicContact CD1-CD1 4.46Å
335	N	96.8	Very high	96.9	Very high	80 Å²	80	55.4 Å²	55.4	43%	0.428	30%	0.296	S	S	.	.	H	α-helix	trans	-66.4	-20.6	178.5	-75.8	-24.6	0	0	0	113.8	P331 E332 T333 F337 S360	P331-N335 WeakPolarHBondContact O-CB 3.36Å; P331-N335 PolarHBondContact O-N 2.68Å; P331-N335 PolarHBondContact O-ND2 3.04Å; P331-N335 VanDerWaalsContact O-ND2 3.15Å; E332-N335 PolarHBondContact O-N 2.77Å; T333-N335 PolarHBondContact O-N 3.45Å; N335-F337 PolarHBondContact O-N 2.94Å; N335-S360 WeakPolarHBondContact OD1-CB 3.39Å; N335-S360 PolarHBondContact OD1-OG 3.39Å
336	I	97.4	Very high	96.9	Very high	129 Å²	129	49.6 Å²	49.6	66%	0.662	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.6	175.1	-62.2	169.2	0	0	0	110.8	T333 L334 S338	T333-I336 PolarHBondContact O-N 2.93Å; L334-I336 PolarHBondContact O-N 3.39Å; I336-S338 PolarHBondContact O-N 3.28Å
337	F	97.4	Very high	97	Very high	81 Å²	81	48 Å²	48	36%	0.355	26%	0.258	S	S	.	.			trans	-92	77.8	-179.3	-52.9	-81.1	0	0	0	110.6	F324 L334 N335 D339 I340 W343 K361	F324-F337 HydrophobicContact CD1-CE2 4.31Å; F324-F337 HydrophobicContact CD1-CZ 4.25Å; F324-F337 AromaticContact CE1-CD1 3.87Å; F324-F337 HydrophobicContact CE1-CD1 3.87Å; F324-F337 HydrophobicContact CE1-CD2 4.09Å; F324-F337 AromaticContact CE1-CE1 3.7Å; F324-F337 HydrophobicContact CE1-CE1 3.7Å; F324-F337 AromaticContact CE1-CE2 3.92Å; F324-F337 HydrophobicContact CE1-CE2 3.92Å; F324-F337 HydrophobicContact CE1-CG 4.07Å; F324-F337 AromaticContact CE1-CZ 3.72Å; F324-F337 HydrophobicContact CE1-CZ 3.72Å; F324-F337 HydrophobicContact CZ-CD1 4.23Å; F324-F337 HydrophobicContact CZ-CE1 4.47Å; F324-F337 HydrophobicContact CZ-CG 4.32Å; L334-F337 PolarHBondContact O-N 3.29Å; N335-F337 PolarHBondContact O-N 2.94Å; F337-D339 PolarHBondContact O-N 2.84Å; F337-I340 HydrophobicContact CB-CB 4.49Å; F337-I340 HydrophobicContact CB-CG1 3.89Å; F337-I340 PolarHBondContact O-N 3.02Å; F337-W343 HydrophobicContact CB-CH2 4.02Å; F337-W343 HydrophobicContact CB-CZ2 3.94Å; F337-W343 AromaticContact CD2-CH2 3.85Å; F337-W343 HydrophobicContact CD2-CH2 3.85Å; F337-W343 HydrophobicContact CD2-CZ2 4.2Å; F337-W343 HydrophobicContact CG-CH2 4.15Å; F337-W343 HydrophobicContact CG-CZ2 4.46Å; F337-K361 PolarHBondContact O-NZ 2.92Å
338	S	95.6	Very high	97.1	Very high	88 Å²	88	47 Å²	47	62%	0.615	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.3	-177.8	55.2	0	0	0	0	113.8	I336 K361	I336-S338 PolarHBondContact O-N 3.28Å; S338-K361 PolarHBondContact O-NZ 3.35Å
339	D	97.2	Very high	97.3	Very high	106 Å²	106	42.6 Å²	42.6	57%	0.567	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-25.7	-173.7	-63.4	-8.5	0	0	0	113.7	K290 F337 E341	K290-D339 HydrophobicContact CD-CB 4.06Å; K290-D339 WeakPolarHBondContact CD-O 3.47Å; F337-D339 PolarHBondContact O-N 2.84Å; D339-E341 PolarHBondContact O-N 2.87Å
340	I	98.4	Very high	97.3	Very high	6 Å²	6	41.9 Å²	41.9	3%	0.031	22%	0.224	C	C	.	.			trans	-68.9	123.3	179.1	-61.2	-60.7	0	0	0	108.9	K290 F322 F324 F337 C342 W343 K361	K290-I340 HydrophobicContact CD-CD1 4.09Å; K290-I340 HydrophobicContact CG-CD1 4.01Å; F322-I340 HydrophobicContact CB-CD1 4.07Å; F322-I340 HydrophobicContact CD2-CD1 3.63Å; F322-I340 HydrophobicContact CE2-CD1 4.4Å; F322-I340 HydrophobicContact CG-CD1 4.06Å; F324-I340 HydrophobicContact CE2-CD1 4.14Å; F324-I340 HydrophobicContact CE2-CG1 4.35Å; F324-I340 HydrophobicContact CZ-CD1 4.2Å; F324-I340 HydrophobicContact CZ-CG1 4.17Å; F337-I340 HydrophobicContact CB-CB 4.49Å; F337-I340 HydrophobicContact CB-CG1 3.89Å; F337-I340 PolarHBondContact O-N 3.02Å; I340-C342 WeakPolarHBondContact CG2-O 3.34Å; I340-W343 HydrophobicContact CB-CH2 4.09Å; I340-W343 HydrophobicContact CB-CZ2 3.75Å; I340-W343 HydrophobicContact CG1-CH2 3.83Å; I340-W343 HydrophobicContact CG1-CZ2 3.98Å; I340-W343 HydrophobicContact CG1-CZ3 4.45Å; I340-W343 HydrophobicContact CG2-CD2 3.8Å; I340-W343 HydrophobicContact CG2-CE3 4.05Å; I340-W343 HydrophobicContact CG2-CG 4.43Å; I340-W343 HydrophobicContact CG2-CH2 3.99Å; I340-W343 HydrophobicContact CG2-CZ2 3.72Å; I340-W343 HydrophobicContact CG2-CZ3 4.15Å; I340-K361 WeakPolarHBondContact O-CD 3.44Å; I340-K361 WeakPolarHBondContact O-CE 3.45Å; I340-K361 PolarHBondContact O-NZ 3.12Å
341	E	98.5	Very high	97.4	Very high	87 Å²	87	41.1 Å²	41.1	41%	0.407	22%	0.22	S	C	.	.			trans	-92.4	-29.7	-174.6	-62.1	170.2	142.6	0	0	112.7	C288 H289 K290 D339	C288-E341 HydrophobicContact CB-CB 3.85Å; H289-E341 WeakPolarHBondContact CA-OE2 3.16Å; H289-E341 PolarHBondContact N-OE2 3.12Å; K290-E341 HydrophobicContact CB-CG 4.46Å; K290-E341 PolarHBondContact N-OE2 3.48Å; K290-E341 PolarHBondContact O-N 3.39Å; D339-E341 PolarHBondContact O-N 2.87Å
342	C	98.7	Very high	97.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	138.9	179.7	-178.2	0	0	0	0	111	C288 K290 F291 G292 I340	C288-C342 HydrophobicContact CB-CB 3.95Å; K290-C342 PolarHBondContact O-N 3.36Å; F291-C342 WeakPolarHBondContact CA-O 3.48Å; F291-C342 HydrophobicContact CD1-CB 3.69Å; F291-C342 HydrophobicContact CE1-CB 3.6Å; F291-C342 HydrophobicContact CG-CB 4.4Å; F291-C342 HydrophobicContact CZ-CB 4.23Å; G292-C342 PolarHBondContact N-O 3.4Å; I340-C342 WeakPolarHBondContact CG2-O 3.34Å
343	W	98.7	Very high	97.5	Very high	2 Å²	2	34 Å²	34	1%	0.008	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	141.6	175.3	-63.7	102.8	0	0	0	111.1	G292 I294 F324 L334 F337 I340 P362 L363 L364	G292-W343 CarbonylContact O-C 3.59Å; G292-W343 WeakPolarHBondContact O-CA 3.31Å; I294-W343 HydrophobicContact CD1-CB 4.48Å; I294-W343 HydrophobicContact CD1-CD2 4.35Å; I294-W343 HydrophobicContact CD1-CE3 3.76Å; I294-W343 HydrophobicContact CD1-CZ3 4.37Å; I294-W343 HydrophobicContact CG1-CE3 3.83Å; I294-W343 HydrophobicContact CG1-CZ3 4.18Å; F324-W343 HydrophobicContact CD1-CZ3 4.43Å; F324-W343 HydrophobicContact CD2-CH2 4.28Å; F324-W343 AromaticContact CD2-CZ3 3.57Å; F324-W343 HydrophobicContact CD2-CZ3 3.57Å; F324-W343 HydrophobicContact CE1-CH2 4.23Å; F324-W343 HydrophobicContact CE1-CZ3 4.43Å; F324-W343 AromaticContact CE2-CH2 3.91Å; F324-W343 HydrophobicContact CE2-CH2 3.91Å; F324-W343 AromaticContact CE2-CZ3 3.55Å; F324-W343 HydrophobicContact CE2-CZ3 3.55Å; F324-W343 HydrophobicContact CG-CZ3 4.02Å; F324-W343 AromaticContact CZ-CH2 3.89Å; F324-W343 HydrophobicContact CZ-CH2 3.89Å; F324-W343 HydrophobicContact CZ-CZ3 4.02Å; L334-W343 HydrophobicContact CB-CZ2 3.92Å; L334-W343 HydrophobicContact CD1-CB 4.41Å; L334-W343 HydrophobicContact CD1-CD2 3.89Å; L334-W343 HydrophobicContact CD1-CE3 4.45Å; L334-W343 HydrophobicContact CD1-CG 3.84Å; L334-W343 HydrophobicContact CD2-CD2 4.17Å; L334-W343 HydrophobicContact CD2-CE3 4.11Å; L334-W343 HydrophobicContact CD2-CH2 3.94Å; L334-W343 HydrophobicContact CD2-CZ2 3.99Å; L334-W343 HydrophobicContact CD2-CZ3 3.99Å; L334-W343 HydrophobicContact CG-CD2 4.42Å; L334-W343 HydrophobicContact CG-CZ2 4.4Å; L334-W343 WeakPolarHBondContact O-CZ2 3.3Å; F337-W343 HydrophobicContact CB-CH2 4.02Å; F337-W343 HydrophobicContact CB-CZ2 3.94Å; F337-W343 AromaticContact CD2-CH2 3.85Å; F337-W343 HydrophobicContact CD2-CH2 3.85Å; F337-W343 HydrophobicContact CD2-CZ2 4.2Å; F337-W343 HydrophobicContact CG-CH2 4.15Å; F337-W343 HydrophobicContact CG-CZ2 4.46Å; I340-W343 HydrophobicContact CB-CH2 4.09Å; I340-W343 HydrophobicContact CB-CZ2 3.75Å; I340-W343 HydrophobicContact CG1-CH2 3.83Å; I340-W343 HydrophobicContact CG1-CZ2 3.98Å; I340-W343 HydrophobicContact CG1-CZ3 4.45Å; I340-W343 HydrophobicContact CG2-CD2 3.8Å; I340-W343 HydrophobicContact CG2-CE3 4.05Å; I340-W343 HydrophobicContact CG2-CG 4.43Å; I340-W343 HydrophobicContact CG2-CH2 3.99Å; I340-W343 HydrophobicContact CG2-CZ2 3.72Å; I340-W343 HydrophobicContact CG2-CZ3 4.15Å; W343-P362 PolarHBondContact N-O 3.08Å; W343-L363 HydrophobicContact CB-CD1 3.55Å; W343-L363 WeakPolarHBondContact O-CA 3.43Å; W343-L364 PolarHBondContact O-N 3.28Å
344	V	98.7	Very high	97.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	121.2	172.1	-170.7	0	0	0	0	108	F291 G292 I293 I294 L310 L364 L369	F291-V344 HydrophobicContact CD1-CG2 4.13Å; G292-V344 PolarHBondContact O-N 2.97Å; I293-V344 CarbonylContact C-O 3.55Å; I293-V344 WeakPolarHBondContact CA-O 3.4Å; I294-V344 PolarHBondContact N-O 3.21Å; L310-V344 HydrophobicContact CD1-CG1 3.9Å; V344-L364 WeakPolarHBondContact CA-O 3.42Å; V344-L364 HydrophobicContact CG1-CB 4.48Å; V344-L364 HydrophobicContact CG2-CB 4.35Å; V344-L369 HydrophobicContact CG1-CB 4.01Å; V344-L369 HydrophobicContact CG1-CD2 4.1Å; V344-L369 HydrophobicContact CG2-CB 4.29Å; V344-L369 HydrophobicContact CG2-CD1 4.01Å; V344-L369 HydrophobicContact CG2-CD2 4.03Å; V344-L369 HydrophobicContact CG2-CG 4.31Å
345	Q	98.5	Very high	97.4	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130	-178.2	62.3	82.1	21.6	0	0	111.8	I294 I329 A347 C348 S352 L363 L364 P366	I294-Q345 HydrophobicContact CB-CB 4.35Å; I329-Q345 HydrophobicContact CD1-CB 3.79Å; Q345-A347 VanDerWaalsContact OE1-C 3.31Å; Q345-A347 VanDerWaalsContact OE1-CA 3.29Å; Q345-A347 VanDerWaalsContact OE1-CB 3.3Å; Q345-C348 PolarHBondContact NE2-O 3.24Å; Q345-C348 VanDerWaalsContact NE2-O 3.13Å; Q345-C348 PolarHBondContact OE1-O 3.37Å; Q345-S352 WeakPolarHBondContact CG-OG 3.5Å; Q345-S352 PolarHBondContact NE2-OG 3.28Å; Q345-L363 HydrophobicContact CB-CD1 4.07Å; Q345-L363 HydrophobicContact CG-CD1 3.96Å; Q345-L363 HydrophobicContact CG-CD2 4.44Å; Q345-L363 HydrophobicContact CG-CG 4.18Å; Q345-L364 PolarHBondContact N-O 2.92Å; Q345-P366 VanDerWaalsContact O-CD 3.28Å; Q345-P366 WeakPolarHBondContact O-CD 3.35Å
346	V	98.4	Very high	97.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	75.4	166.5	-172.1	0	0	0	0	106.6	I293 I294 G296 G302 N303 I306 V307 L310 P366	I293-V346 HydrophobicContact CG2-CG2 4.39Å; I294-V346 PolarHBondContact O-N 3.42Å; G296-V346 PolarHBondContact N-O 3.48Å; G302-V346 VanDerWaalsContact CA-O 3.25Å; G302-V346 WeakPolarHBondContact CA-O 3.44Å; N303-V346 HydrophobicContact CB-CG1 4.27Å; I306-V346 HydrophobicContact CB-CG1 3.88Å; I306-V346 HydrophobicContact CD1-CG1 4.34Å; I306-V346 HydrophobicContact CG2-CG1 3.88Å; I306-V346 HydrophobicContact CG2-CG2 3.88Å; V307-V346 HydrophobicContact CG2-CB 3.95Å; V307-V346 HydrophobicContact CG2-CG1 4.32Å; V307-V346 HydrophobicContact CG2-CG2 3.69Å; L310-V346 HydrophobicContact CD1-CG2 3.56Å; V346-P366 HydrophobicContact CG2-CG 4.16Å
347	A	97.2	Very high	97.2	Very high	2 Å²	2	35 Å²	35	2%	0.017	19%	0.187	C	C	.	.	S	Bend	trans	-148.2	-133.4	179.9	0	0	0	0	0	109.5	Q301 I329 Q345 P349 L351 Y386	Q301-A347 HydrophobicContact CB-CB 4.46Å; I329-A347 HydrophobicContact CD1-CB 3.89Å; Q345-A347 VanDerWaalsContact OE1-C 3.31Å; Q345-A347 VanDerWaalsContact OE1-CA 3.29Å; Q345-A347 VanDerWaalsContact OE1-CB 3.3Å; A347-P349 WeakPolarHBondContact O-CD 3.39Å; A347-L351 HydrophobicContact CB-CD1 4.42Å; A347-Y386 VanDerWaalsContact O-CE1 3.24Å; A347-Y386 WeakPolarHBondContact O-CE1 3.28Å; A347-Y386 PolarHBondContact O-OH 2.92Å
348	C	97.1	Very high	97.1	Very high	29 Å²	29	37.4 Å²	37.4	20%	0.196	20%	0.201	C	C	.	.			trans	-73.6	118.1	171.2	-178.8	0	0	0	0	111.4	Q345 R350 L351	Q345-C348 PolarHBondContact NE2-O 3.24Å; Q345-C348 VanDerWaalsContact NE2-O 3.13Å; Q345-C348 PolarHBondContact OE1-O 3.37Å; C348-R350 PolarHBondContact O-N 3.37Å; C348-L351 HydrophobicContact CB-CD1 4.12Å; C348-L351 HydrophobicContact CB-CG 4.19Å; C348-L351 WeakPolarHBondContact O-CB 3.37Å; C348-L351 PolarHBondContact O-N 3.2Å; C348-L351 VanDerWaalsContact O-N 3.13Å
349	P	97.3	Very high	97.1	Very high	13 Å²	13	34.1 Å²	34.1	8%	0.084	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-28.1	179.4	-27	35.7	0	0	0	114.4	C220 A347 L351 S352 I353 T365 Y386	C220-P349 HydrophobicContact CB-CG 3.92Å; A347-P349 WeakPolarHBondContact O-CD 3.39Å; P349-L351 PolarHBondContact O-N 3.44Å; P349-S352 PolarHBondContact O-N 3.35Å; P349-I353 HydrophobicContact CB-CD1 4.32Å; P349-I353 WeakPolarHBondContact O-CG1 3.36Å; P349-I353 PolarHBondContact O-N 3.49Å; P349-T365 HydrophobicContact CB-CG2 4.28Å; P349-Y386 HydrophobicContact CG-CD1 3.45Å; P349-Y386 VanDerWaalsContact CG-CD1 3.45Å; P349-Y386 HydrophobicContact CG-CD2 3.99Å; P349-Y386 HydrophobicContact CG-CE1 3.9Å; P349-Y386 HydrophobicContact CG-CE2 4.41Å; P349-Y386 HydrophobicContact CG-CG 3.49Å; P349-Y386 VanDerWaalsContact CG-CG 3.49Å
350	R	96.5	Very high	97.1	Very high	1 Å²	1	33 Å²	33	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-66	-25.2	-177.9	-66.4	-70.6	-62.9	-92.3	2	113	G219 F240 E243 C348 S352 I353 D354 W355	G219-R350 VanDerWaalsContact O-CD 3.29Å; G219-R350 WeakPolarHBondContact O-CD 3.49Å; G219-R350 VanDerWaalsContact O-CG 3.29Å; G219-R350 WeakPolarHBondContact O-CG 3.38Å; F240-R350 VanDerWaalsContact CD2-CZ 3.42Å; F240-R350 HydrophobicContact CE2-CB 3.74Å; F240-R350 HydrophobicContact CE2-CG 3.65Å; F240-R350 VanDerWaalsContact CE2-CZ 3.48Å; F240-R350 HydrophobicContact CZ-CB 3.96Å; F240-R350 HydrophobicContact CZ-CG 3.62Å; F240-R350 PolarHBondContact O-NH1 3.44Å; E243-R350 IonicContact OE2-NH2 3.43Å; E243-R350 PolarHBondContact OE2-NH2 2.72Å; C348-R350 PolarHBondContact O-N 3.37Å; R350-S352 VanDerWaalsContact C-N 3.26Å; R350-S352 PolarHBondContact O-N 3.1Å; R350-I353 PolarHBondContact O-N 2.89Å; R350-D354 IonicContact CZ-OD1 3.21Å; R350-D354 IonicContact CZ-OD2 2.58Å; R350-D354 IonicContact NE-OD1 2.79Å; R350-D354 PolarHBondContact NE-OD1 3.36Å; R350-D354 IonicContact NE-OD2 3.18Å; R350-D354 PolarHBondContact NE-OD2 3.08Å; R350-D354 VanDerWaalsContact NH2-CG 3.31Å; R350-D354 IonicContact NH2-OD1 2.68Å; R350-D354 PolarHBondContact NH2-OD1 2.85Å; R350-D354 IonicContact NH2-OD2 2.78Å; R350-D354 PolarHBondContact NH2-OD2 3.43Å; R350-D354 PolarHBondContact O-N 3.06Å; R350-W355 HydrophobicContact CB-CZ3 3.9Å
351	L	96.8	Very high	97	Very high	35 Å²	35	34.6 Å²	34.6	18%	0.183	18%	0.183	C	C	.	.	H	α-helix	trans	-52.8	-45	172.1	-69.2	169.8	0	0	0	112	I329 A347 C348 P349 W355 G356 L363	I329-L351 HydrophobicContact CB-CD1 4.14Å; I329-L351 HydrophobicContact CD1-CD1 3.85Å; I329-L351 HydrophobicContact CG1-CD1 4.36Å; A347-L351 HydrophobicContact CB-CD1 4.42Å; C348-L351 HydrophobicContact CB-CD1 4.12Å; C348-L351 HydrophobicContact CB-CG 4.19Å; C348-L351 WeakPolarHBondContact O-CB 3.37Å; C348-L351 PolarHBondContact O-N 3.2Å; C348-L351 VanDerWaalsContact O-N 3.13Å; P349-L351 PolarHBondContact O-N 3.44Å; L351-W355 HydrophobicContact CD2-CE3 4.2Å; L351-W355 HydrophobicContact CD2-CZ3 4.43Å; L351-W355 CarbonylContact O-C 3.55Å; L351-W355 WeakPolarHBondContact O-CA 3.47Å; L351-W355 WeakPolarHBondContact O-CB 3.48Å; L351-W355 PolarHBondContact O-N 3.34Å; L351-G356 PolarHBondContact O-N 3.17Å; L351-G356 VanDerWaalsContact O-N 3.1Å; L351-L363 HydrophobicContact CB-CD2 4.44Å
352	S	97.9	Very high	97	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-75	-46.8	175.4	-57.7	0	0	0	0	111.7	R278 Q345 P349 R350 G356 L363 L364 T365	R278-S352 VanDerWaalsContact CZ-O 3.25Å; R278-S352 PolarHBondContact NH1-O 2.92Å; Q345-S352 WeakPolarHBondContact CG-OG 3.5Å; Q345-S352 PolarHBondContact NE2-OG 3.28Å; P349-S352 PolarHBondContact O-N 3.35Å; R350-S352 VanDerWaalsContact C-N 3.26Å; R350-S352 PolarHBondContact O-N 3.1Å; S352-G356 VanDerWaalsContact O-CA 3.3Å; S352-G356 WeakPolarHBondContact O-CA 3.27Å; S352-G356 PolarHBondContact O-N 2.99Å; S352-G356 VanDerWaalsContact O-N 3.15Å; S352-L363 WeakPolarHBondContact CB-O 3.26Å; S352-L363 PolarHBondContact OG-O 2.8Å; S352-L364 VanDerWaalsContact OG-C 3.31Å; S352-L364 PolarHBondContact OG-O 3.43Å; S352-T365 VanDerWaalsContact CB-CG2 3.46Å; S352-T365 PolarHBondContact OG-N 3.06Å
353	I	97.5	Very high	97	Very high	11 Å²	11	31.1 Å²	31.1	6%	0.056	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-48.4	-172.2	-62.3	165.9	0	0	0	111.8	I247 M274 P349 R350 Y382 M384	I247-I353 HydrophobicContact CD1-CG2 4.17Å; M274-I353 HydrophobicContact CG-CG2 4.07Å; P349-I353 HydrophobicContact CB-CD1 4.32Å; P349-I353 WeakPolarHBondContact O-CG1 3.36Å; P349-I353 PolarHBondContact O-N 3.49Å; R350-I353 PolarHBondContact O-N 2.89Å; I353-Y382 HydrophobicContact CD1-CD1 4.34Å; I353-Y382 HydrophobicContact CD1-CE1 3.62Å; I353-Y382 HydrophobicContact CG1-CE1 4.03Å; I353-M384 HydrophobicContact CD1-CE 4.27Å; I353-M384 HydrophobicContact CD1-SD 3.98Å
354	D	95.5	Very high	97	Very high	46 Å²	46	31 Å²	31	25%	0.246	17%	0.167	C	C	.	.	H	α-helix	trans	-95.3	-42.1	-173.2	-55.5	-24	0	0	0	112.6	R350	R350-D354 IonicContact CZ-OD1 3.21Å; R350-D354 IonicContact CZ-OD2 2.58Å; R350-D354 IonicContact NE-OD1 2.79Å; R350-D354 PolarHBondContact NE-OD1 3.36Å; R350-D354 IonicContact NE-OD2 3.18Å; R350-D354 PolarHBondContact NE-OD2 3.08Å; R350-D354 VanDerWaalsContact NH2-CG 3.31Å; R350-D354 IonicContact NH2-OD1 2.68Å; R350-D354 PolarHBondContact NH2-OD1 2.85Å; R350-D354 IonicContact NH2-OD2 2.78Å; R350-D354 PolarHBondContact NH2-OD2 3.43Å; R350-D354 PolarHBondContact O-N 3.06Å
355	W	94.9	Very high	97	Very high	118 Å²	118	31.2 Å²	31.2	45%	0.447	17%	0.168	S	C	.	.	H	α-helix	trans	-104.7	-1.2	-171.6	-60.1	-83.6	0	0	0	113.4	F240 R350 L351 V357 M358 F359	F240-W355 HydrophobicContact CE2-CH2 4.25Å; R350-W355 HydrophobicContact CB-CZ3 3.9Å; L351-W355 HydrophobicContact CD2-CE3 4.2Å; L351-W355 HydrophobicContact CD2-CZ3 4.43Å; L351-W355 CarbonylContact O-C 3.55Å; L351-W355 WeakPolarHBondContact O-CA 3.47Å; L351-W355 WeakPolarHBondContact O-CB 3.48Å; L351-W355 PolarHBondContact O-N 3.34Å; W355-V357 PolarHBondContact O-N 3.07Å; W355-M358 VanDerWaalsContact O-CB 3.31Å; W355-M358 WeakPolarHBondContact O-CB 3.35Å; W355-M358 PolarHBondContact O-N 3.35Å; W355-F359 HydrophobicContact CB-CE2 4.35Å; W355-F359 VanDerWaalsContact O-CD2 3.26Å; W355-F359 WeakPolarHBondContact O-CD2 3.45Å; W355-F359 WeakPolarHBondContact O-CE2 3.46Å
356	G	95.4	Very high	97	Very high	10 Å²	10	31.3 Å²	31.3	10%	0.103	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-55.1	-28.1	-176.4	0	0	0	0	0	114.3	L351 S352 M358 F359	L351-G356 PolarHBondContact O-N 3.17Å; L351-G356 VanDerWaalsContact O-N 3.1Å; S352-G356 VanDerWaalsContact O-CA 3.3Å; S352-G356 WeakPolarHBondContact O-CA 3.27Å; S352-G356 PolarHBondContact O-N 2.99Å; S352-G356 VanDerWaalsContact O-N 3.15Å; G356-M358 VanDerWaalsContact C-N 3.3Å; G356-M358 PolarHBondContact O-N 3.47Å; G356-F359 PolarHBondContact O-N 3.14Å
357	V	94.6	Very high	97	Very high	98 Å²	98	31.8 Å²	31.8	59%	0.594	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	-73.8	-16.7	176.4	-63.3	0	0	0	0	114.4	T277 W355	T277-V357 HydrophobicContact CG2-CG1 3.24Å; W355-V357 PolarHBondContact O-N 3.07Å
358	M	95.5	Very high	97.1	Very high	132 Å²	132	31.7 Å²	31.7	65%	0.65	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-80.9	-9.7	177	-58	-61.5	-122	0	0	112	P331 W355 G356	P331-M358 HydrophobicContact CG-CB 4.31Å; P331-M358 WeakPolarHBondContact CG-O 3.5Å; W355-M358 VanDerWaalsContact O-CB 3.31Å; W355-M358 WeakPolarHBondContact O-CB 3.35Å; W355-M358 PolarHBondContact O-N 3.35Å; G356-M358 VanDerWaalsContact C-N 3.3Å; G356-M358 PolarHBondContact O-N 3.47Å
359	F	96.9	Very high	97.2	Very high	19 Å²	19	30.3 Å²	30.3	8%	0.083	16%	0.16	C	C	.	.	S	Bend	trans	-91.3	138.2	176.5	-63.6	-92.6	0	0	0	109.9	I329 P331 L334 W355 G356 K361 L363	I329-F359 HydrophobicContact CG2-CE1 4.03Å; I329-F359 HydrophobicContact CG2-CZ 4.07Å; P331-F359 HydrophobicContact CB-CD1 4.32Å; P331-F359 HydrophobicContact CG-CD1 4.15Å; P331-F359 HydrophobicContact CG-CE1 4.05Å; P331-F359 HydrophobicContact CG-CG 4.49Å; P331-F359 HydrophobicContact CG-CZ 4.29Å; L334-F359 HydrophobicContact CD1-CD1 3.73Å; L334-F359 HydrophobicContact CD1-CE1 3.67Å; L334-F359 HydrophobicContact CG-CE1 4.35Å; W355-F359 HydrophobicContact CB-CE2 4.35Å; W355-F359 VanDerWaalsContact O-CD2 3.26Å; W355-F359 WeakPolarHBondContact O-CD2 3.45Å; W355-F359 WeakPolarHBondContact O-CE2 3.46Å; G356-F359 PolarHBondContact O-N 3.14Å; F359-K361 WeakPolarHBondContact CB-O 3.36Å; F359-K361 PolarHBondContact O-N 3.18Å; F359-L363 HydrophobicContact CB-CB 4.44Å; F359-L363 HydrophobicContact CD1-CD2 4.32Å; F359-L363 HydrophobicContact CD2-CB 4.14Å; F359-L363 HydrophobicContact CD2-CD2 3.69Å; F359-L363 HydrophobicContact CE1-CD2 4.02Å; F359-L363 HydrophobicContact CE2-CD2 3.37Å; F359-L363 HydrophobicContact CG-CB 4.17Å; F359-L363 HydrophobicContact CG-CD2 4.17Å; F359-L363 HydrophobicContact CZ-CD2 3.55Å
360	S	95.8	Very high	97.2	Very high	82 Å²	82	30 Å²	30	57%	0.573	16%	0.158	S	C	*	.	S	Bend	trans	-67	-18.2	178.7	63.5	0	0	0	0	113.4	N335	N335-S360 WeakPolarHBondContact OD1-CB 3.39Å; N335-S360 PolarHBondContact OD1-OG 3.39Å
361	K	97.3	Very high	97.3	Very high	41 Å²	41	30.8 Å²	30.8	18%	0.178	16%	0.163	C	C	.	.	S	Bend	trans	-130.9	154.9	-177.2	-62.3	179.6	-177.2	170.8	0	109.3	F337 S338 I340 F359 L363	F337-K361 PolarHBondContact O-NZ 2.92Å; S338-K361 PolarHBondContact O-NZ 3.35Å; I340-K361 WeakPolarHBondContact O-CD 3.44Å; I340-K361 WeakPolarHBondContact O-CE 3.45Å; I340-K361 PolarHBondContact O-NZ 3.12Å; F359-K361 WeakPolarHBondContact CB-O 3.36Å; F359-K361 PolarHBondContact O-N 3.18Å; K361-L363 PolarHBondContact O-N 2.82Å
362	P	98.2	Very high	97.4	Very high	12 Å²	12	29.5 Å²	29.5	8%	0.078	16%	0.157	C	C	.	.			trans	-53	125.7	179.2	-24.2	31.6	0	0	0	111.9	A281 Q284 W343 L364	A281-P362 HydrophobicContact CB-CB 4.24Å; Q284-P362 HydrophobicContact CB-CG 3.61Å; Q284-P362 VanDerWaalsContact OE1-CG 3.31Å; W343-P362 PolarHBondContact N-O 3.08Å; P362-L364 HydrophobicContact CB-CD2 4.42Å
363	L	98.5	Very high	97.4	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	104.2	168.6	-178.7	68.1	0	0	0	109	R278 I294 I329 L334 W343 Q345 L351 S352 F359 K361	R278-L363 PolarHBondContact NH1-O 2.85Å; R278-L363 PolarHBondContact NH2-O 2.81Å; I294-L363 HydrophobicContact CD1-CD1 4.33Å; I329-L363 HydrophobicContact CG2-CD2 4.48Å; L334-L363 HydrophobicContact CD1-CD1 4.46Å; W343-L363 HydrophobicContact CB-CD1 3.55Å; W343-L363 WeakPolarHBondContact O-CA 3.43Å; Q345-L363 HydrophobicContact CB-CD1 4.07Å; Q345-L363 HydrophobicContact CG-CD1 3.96Å; Q345-L363 HydrophobicContact CG-CD2 4.44Å; Q345-L363 HydrophobicContact CG-CG 4.18Å; L351-L363 HydrophobicContact CB-CD2 4.44Å; S352-L363 WeakPolarHBondContact CB-O 3.26Å; S352-L363 PolarHBondContact OG-O 2.8Å; F359-L363 HydrophobicContact CB-CB 4.44Å; F359-L363 HydrophobicContact CD1-CD2 4.32Å; F359-L363 HydrophobicContact CD2-CB 4.14Å; F359-L363 HydrophobicContact CD2-CD2 3.69Å; F359-L363 HydrophobicContact CE1-CD2 4.02Å; F359-L363 HydrophobicContact CE2-CD2 3.37Å; F359-L363 HydrophobicContact CG-CB 4.17Å; F359-L363 HydrophobicContact CG-CD2 4.17Å; F359-L363 HydrophobicContact CZ-CD2 3.55Å; K361-L363 PolarHBondContact O-N 2.82Å
364	L	98.7	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	148.7	-176.8	-56.5	-171.2	0	0	0	112.7	A281 I282 A285 W343 V344 Q345 S352 P362 E368 L369	A281-L364 HydrophobicContact CB-CD2 3.77Å; I282-L364 HydrophobicContact CG1-CD2 4.43Å; A285-L364 HydrophobicContact CB-CD1 3.58Å; A285-L364 HydrophobicContact CB-CG 4.45Å; W343-L364 PolarHBondContact O-N 3.28Å; V344-L364 WeakPolarHBondContact CA-O 3.42Å; V344-L364 HydrophobicContact CG1-CB 4.48Å; V344-L364 HydrophobicContact CG2-CB 4.35Å; Q345-L364 PolarHBondContact N-O 2.92Å; S352-L364 VanDerWaalsContact OG-C 3.31Å; S352-L364 PolarHBondContact OG-O 3.43Å; P362-L364 HydrophobicContact CB-CD2 4.42Å; L364-E368 HydrophobicContact CB-CB 4.18Å; L364-E368 HydrophobicContact CD2-CB 4.26Å; L364-L369 HydrophobicContact CD1-CB 4.42Å; L364-L369 HydrophobicContact CD1-CD1 4.44Å
365	T	98.7	Very high	97.4	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.025	20%	0.198	C	C	.	.			trans	-75.3	165.1	159.2	64.9	0	0	0	0	110.5	P349 S352 Y367 E368 L369 Y382	P349-T365 HydrophobicContact CB-CG2 4.28Å; S352-T365 VanDerWaalsContact CB-CG2 3.46Å; S352-T365 PolarHBondContact OG-N 3.06Å; T365-Y367 VanDerWaalsContact C-N 3.28Å; T365-Y367 PolarHBondContact O-N 3.31Å; T365-E368 WeakPolarHBondContact CB-OE2 3.39Å; T365-E368 WeakPolarHBondContact CG2-OE2 3.42Å; T365-E368 PolarHBondContact N-OE2 2.87Å; T365-E368 PolarHBondContact O-N 3.27Å; T365-E368 VanDerWaalsContact OG1-CD 3.24Å; T365-E368 WeakPolarHBondContact OG1-CG 3.37Å; T365-E368 PolarHBondContact OG1-N 2.82Å; T365-E368 PolarHBondContact OG1-OE2 3.14Å; T365-L369 PolarHBondContact O-N 2.85Å; T365-L369 VanDerWaalsContact O-N 3.1Å; T365-Y382 PolarHBondContact OG1-OH 3.1Å
366	P	98.6	Very high	97.5	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-58.7	-38.7	174.6	-28.9	40.9	0	0	0	113	I306 L310 Q345 V346 L369 M370 Y386 W395	I306-P366 HydrophobicContact CG2-CB 4.02Å; I306-P366 HydrophobicContact CG2-CG 4.09Å; L310-P366 HydrophobicContact CD1-CB 4.01Å; L310-P366 HydrophobicContact CD1-CG 4.2Å; L310-P366 HydrophobicContact CD2-CB 4.16Å; Q345-P366 VanDerWaalsContact O-CD 3.28Å; Q345-P366 WeakPolarHBondContact O-CD 3.35Å; V346-P366 HydrophobicContact CG2-CG 4.16Å; P366-L369 PolarHBondContact O-N 3.06Å; P366-M370 VanDerWaalsContact O-CG 3.26Å; P366-M370 WeakPolarHBondContact O-CG 3.49Å; P366-M370 PolarHBondContact O-N 3.49Å; P366-M370 VanDerWaalsContact O-N 3.17Å; P366-Y386 HydrophobicContact CG-CE2 4.41Å; P366-W395 HydrophobicContact CB-CB 3.74Å; P366-W395 WeakPolarHBondContact CB-O 3.38Å
367	Y	98.6	Very high	97.6	Very high	10 Å²	10	40.9 Å²	40.9	4%	0.039	21%	0.213	C	C	.	.	H	α-helix	trans	-58.8	-48.3	175.5	168.1	-117.8	0	0	0	111.7	T365 L369 M370 V371 T376 Q377 W378 E379 Y382 P383 W395	T365-Y367 VanDerWaalsContact C-N 3.28Å; T365-Y367 PolarHBondContact O-N 3.31Å; Y367-L369 PolarHBondContact O-N 3.13Å; Y367-M370 WeakPolarHBondContact O-CB 3.3Å; Y367-M370 PolarHBondContact O-N 3.45Å; Y367-M370 VanDerWaalsContact O-N 3.07Å; Y367-V371 HydrophobicContact CD2-CG2 4.22Å; Y367-V371 HydrophobicContact CE1-CG2 4.16Å; Y367-V371 HydrophobicContact CE2-CG2 3.66Å; Y367-V371 WeakPolarHBondContact O-CG2 3.43Å; Y367-V371 PolarHBondContact O-N 2.88Å; Y367-T376 HydrophobicContact CD2-CG2 4.16Å; Y367-T376 HydrophobicContact CE2-CG2 3.88Å; Y367-Q377 PolarHBondContact OH-O 2.81Å; Y367-W378 HydrophobicContact CE1-CE3 4.35Å; Y367-W378 HydrophobicContact CE1-CZ3 4.36Å; Y367-W378 WeakPolarHBondContact OH-CA 3.49Å; Y367-E379 PolarHBondContact OH-N 3.42Å; Y367-Y382 HydrophobicContact CD1-CE2 4.25Å; Y367-Y382 HydrophobicContact CE1-CE2 4.31Å; Y367-P383 HydrophobicContact CD1-CG 3.63Å; Y367-P383 HydrophobicContact CD2-CG 4.15Å; Y367-P383 HydrophobicContact CE1-CG 3.61Å; Y367-P383 HydrophobicContact CE2-CG 4.13Å; Y367-P383 HydrophobicContact CG-CG 3.91Å; Y367-W395 AromaticContact CD2-CE2 3.81Å; Y367-W395 AromaticContact CD2-CZ2 3.86Å; Y367-W395 HydrophobicContact CD2-CZ2 3.86Å; Y367-W395 AromaticContact CD2-NE1 3.64Å; Y367-W395 HydrophobicContact CE2-CZ2 4.35Å
368	E	98.7	Very high	97.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-69.1	-33.5	-176.3	-66.7	165.5	139.1	0	0	112.5	R278 I282 L364 T365 M370 V371 S372 Y382	R278-E368 WeakPolarHBondContact CB-OE1 3.45Å; R278-E368 WeakPolarHBondContact CG-OE1 3.33Å; R278-E368 IonicContact CZ-OE1 2.68Å; R278-E368 VanDerWaalsContact CZ-OE1 3.31Å; R278-E368 IonicContact CZ-OE2 3.61Å; R278-E368 IonicContact NE-OE1 2.8Å; R278-E368 PolarHBondContact NE-OE1 2.58Å; R278-E368 IonicContact NE-OE2 2.87Å; R278-E368 IonicContact NH2-OE1 2.92Å; R278-E368 PolarHBondContact NH2-OE1 2.94Å; R278-E368 VanDerWaalsContact NH2-OE1 3.12Å; R278-E368 IonicContact NH2-OE2 3.42Å; R278-E368 PolarHBondContact NH2-OE2 3.49Å; I282-E368 HydrophobicContact CD1-CB 3.94Å; I282-E368 HydrophobicContact CD1-CG 3.99Å; I282-E368 HydrophobicContact CG1-CB 3.82Å; I282-E368 HydrophobicContact CG1-CG 4.31Å; L364-E368 HydrophobicContact CB-CB 4.18Å; L364-E368 HydrophobicContact CD2-CB 4.26Å; T365-E368 WeakPolarHBondContact CB-OE2 3.39Å; T365-E368 WeakPolarHBondContact CG2-OE2 3.42Å; T365-E368 PolarHBondContact N-OE2 2.87Å; T365-E368 PolarHBondContact O-N 3.27Å; T365-E368 VanDerWaalsContact OG1-CD 3.24Å; T365-E368 WeakPolarHBondContact OG1-CG 3.37Å; T365-E368 PolarHBondContact OG1-N 2.82Å; T365-E368 PolarHBondContact OG1-OE2 3.14Å; E368-M370 VanDerWaalsContact C-N 3.32Å; E368-V371 PolarHBondContact O-N 3.21Å; E368-S372 WeakPolarHBondContact O-CB 3.36Å; E368-S372 PolarHBondContact O-N 3.3Å; E368-Y382 VanDerWaalsContact CD-OH 3.25Å; E368-Y382 HydrophobicContact CG-CE2 4.24Å; E368-Y382 PolarHBondContact OE1-OH 3.23Å
369	L	98.7	Very high	97.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.7	-45.2	169.3	-179.8	66.7	0	0	0	110.5	F291 L310 L314 V344 L364 T365 P366 Y367 V371 S372 L373	F291-L369 HydrophobicContact CD1-CD1 4.41Å; F291-L369 HydrophobicContact CE1-CD1 3.99Å; L310-L369 HydrophobicContact CB-CD2 3.91Å; L310-L369 HydrophobicContact CD1-CD2 4.49Å; L310-L369 HydrophobicContact CD2-CD2 3.8Å; L310-L369 HydrophobicContact CG-CD2 4.23Å; L314-L369 HydrophobicContact CD1-CD2 3.86Å; L314-L369 HydrophobicContact CD2-CD1 4.03Å; L314-L369 HydrophobicContact CG-CD1 4.43Å; L314-L369 HydrophobicContact CG-CD2 4.05Å; V344-L369 HydrophobicContact CG1-CB 4.01Å; V344-L369 HydrophobicContact CG1-CD2 4.1Å; V344-L369 HydrophobicContact CG2-CB 4.29Å; V344-L369 HydrophobicContact CG2-CD1 4.01Å; V344-L369 HydrophobicContact CG2-CD2 4.03Å; V344-L369 HydrophobicContact CG2-CG 4.31Å; L364-L369 HydrophobicContact CD1-CB 4.42Å; L364-L369 HydrophobicContact CD1-CD1 4.44Å; T365-L369 PolarHBondContact O-N 2.85Å; T365-L369 VanDerWaalsContact O-N 3.1Å; P366-L369 PolarHBondContact O-N 3.06Å; Y367-L369 PolarHBondContact O-N 3.13Å; L369-V371 VanDerWaalsContact C-N 3.27Å; L369-V371 PolarHBondContact O-N 3.28Å; L369-S372 WeakPolarHBondContact O-CA 3.4Å; L369-S372 WeakPolarHBondContact O-CB 3.43Å; L369-S372 PolarHBondContact O-N 3.15Å; L369-L373 HydrophobicContact CD1-CD1 4.05Å; L369-L373 HydrophobicContact CD1-CD2 4.46Å; L369-L373 HydrophobicContact CD1-CG 4.03Å; L369-L373 HydrophobicContact CD2-CD1 4.27Å; L369-L373 HydrophobicContact CG-CD1 3.93Å; L369-L373 HydrophobicContact CG-CG 4.22Å; L369-L373 WeakPolarHBondContact O-CG 3.29Å; L369-L373 PolarHBondContact O-N 3.43Å
370	M	98.5	Very high	97.7	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.034	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-34.3	-180	-64.6	-64.5	-73.9	0	0	112.1	L310 K313 P366 Y367 E368 E374 Q375 T376 W395	L310-M370 HydrophobicContact CD2-CG 4.31Å; L310-M370 HydrophobicContact CD2-SD 4.22Å; K313-M370 HydrophobicContact CG-CE 4.36Å; K313-M370 HydrophobicContact CG-SD 4.15Å; P366-M370 VanDerWaalsContact O-CG 3.26Å; P366-M370 WeakPolarHBondContact O-CG 3.49Å; P366-M370 PolarHBondContact O-N 3.49Å; P366-M370 VanDerWaalsContact O-N 3.17Å; Y367-M370 WeakPolarHBondContact O-CB 3.3Å; Y367-M370 PolarHBondContact O-N 3.45Å; Y367-M370 VanDerWaalsContact O-N 3.07Å; E368-M370 VanDerWaalsContact C-N 3.32Å; M370-E374 PolarHBondContact O-N 2.92Å; M370-Q375 HydrophobicContact CB-CB 4.38Å; M370-Q375 HydrophobicContact CE-CB 3.41Å; M370-Q375 VanDerWaalsContact CE-CB 3.41Å; M370-Q375 HydrophobicContact CE-CG 3.92Å; M370-Q375 PolarHBondContact O-N 3.01Å; M370-Q375 HydrophobicContact SD-CB 4.17Å; M370-Q375 HydrophobicContact SD-CG 4.32Å; M370-T376 HydrophobicContact CB-CG2 3.83Å; M370-T376 PolarHBondContact O-N 3.24Å; M370-W395 HydrophobicContact CB-CD2 4.35Å; M370-W395 HydrophobicContact CB-CE3 3.93Å; M370-W395 HydrophobicContact CB-CZ3 4.18Å; M370-W395 HydrophobicContact CE-CE3 3.89Å; M370-W395 HydrophobicContact CE-CZ3 4.1Å; M370-W395 HydrophobicContact CG-CB 4.19Å; M370-W395 HydrophobicContact CG-CD2 4.02Å; M370-W395 HydrophobicContact CG-CE3 3.58Å; M370-W395 HydrophobicContact CG-CG 4.31Å; M370-W395 HydrophobicContact CG-CZ3 4.27Å
371	V	98.4	Very high	97.7	Very high	17 Å²	17	37.9 Å²	37.9	10%	0.103	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-45	170	178	0	0	0	0	111	I282 Y367 E368 L369 L373 E374 T376 W378	I282-V371 HydrophobicContact CD1-CB 4.31Å; I282-V371 HydrophobicContact CD1-CG1 4.18Å; I282-V371 HydrophobicContact CG2-CG1 4.32Å; Y367-V371 HydrophobicContact CD2-CG2 4.22Å; Y367-V371 HydrophobicContact CE1-CG2 4.16Å; Y367-V371 HydrophobicContact CE2-CG2 3.66Å; Y367-V371 WeakPolarHBondContact O-CG2 3.43Å; Y367-V371 PolarHBondContact O-N 2.88Å; E368-V371 PolarHBondContact O-N 3.21Å; L369-V371 VanDerWaalsContact C-N 3.27Å; L369-V371 PolarHBondContact O-N 3.28Å; V371-L373 PolarHBondContact O-N 3.1Å; V371-E374 PolarHBondContact O-N 3.27Å; V371-E374 VanDerWaalsContact O-N 3.08Å; V371-T376 HydrophobicContact CG2-CG2 3.69Å; V371-W378 HydrophobicContact CG1-CB 4.15Å; V371-W378 HydrophobicContact CG1-CE3 4.39Å
372	S	98.1	Very high	97.7	Very high	9 Å²	9	36.4 Å²	36.4	6%	0.063	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-32.2	177.9	-175.7	0	0	0	0	113.1	K286 E368 L369 E374	K286-S372 WeakPolarHBondContact CG-OG 3.46Å; K286-S372 PolarHBondContact N-OG 3.43Å; E368-S372 WeakPolarHBondContact O-CB 3.36Å; E368-S372 PolarHBondContact O-N 3.3Å; L369-S372 WeakPolarHBondContact O-CA 3.4Å; L369-S372 WeakPolarHBondContact O-CB 3.43Å; L369-S372 PolarHBondContact O-N 3.15Å; S372-E374 VanDerWaalsContact C-N 3.33Å
373	L	97.7	Very high	97.6	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.037	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	10.6	179.1	-59	-178.4	0	0	0	113.1	K313 L314 M317 L369 V371 Q375	K313-L373 HydrophobicContact CB-CD1 3.89Å; L314-L373 HydrophobicContact CD2-CD1 4.19Å; L314-L373 HydrophobicContact CD2-CD2 4.21Å; L314-L373 HydrophobicContact CG-CD1 4.24Å; M317-L373 HydrophobicContact CG-CD2 4.22Å; L369-L373 HydrophobicContact CD1-CD1 4.05Å; L369-L373 HydrophobicContact CD1-CD2 4.46Å; L369-L373 HydrophobicContact CD1-CG 4.03Å; L369-L373 HydrophobicContact CD2-CD1 4.27Å; L369-L373 HydrophobicContact CG-CD1 3.93Å; L369-L373 HydrophobicContact CG-CG 4.22Å; L369-L373 WeakPolarHBondContact O-CG 3.29Å; L369-L373 PolarHBondContact O-N 3.43Å; V371-L373 PolarHBondContact O-N 3.1Å; L373-Q375 HydrophobicContact CB-CG 3.94Å; L373-Q375 PolarHBondContact O-N 3.36Å; L373-Q375 PolarHBondContact O-NE2 2.98Å; L373-Q375 VanDerWaalsContact O-NE2 3.1Å
374	E	96.7	Very high	97.6	Very high	158 Å²	158	36.7 Å²	36.7	74%	0.738	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	24.3	-179.1	-57.1	-179.9	-179.2	0	0	113.8	M370 V371 S372	M370-E374 PolarHBondContact O-N 2.92Å; V371-E374 PolarHBondContact O-N 3.27Å; V371-E374 VanDerWaalsContact O-N 3.08Å; S372-E374 VanDerWaalsContact C-N 3.33Å
375	Q	96.7	Very high	97.5	Very high	84 Å²	84	37.8 Å²	37.8	39%	0.393	19%	0.192	S	C	.	.	S	Bend	trans	-84.9	-14.6	177	-58.2	-60.5	-69.9	0	0	112.4	K313 M370 L373	K313-Q375 HydrophobicContact CD-CG 4.23Å; K313-Q375 VanDerWaalsContact CE-OE1 3.28Å; M370-Q375 HydrophobicContact CB-CB 4.38Å; M370-Q375 HydrophobicContact CE-CB 3.41Å; M370-Q375 VanDerWaalsContact CE-CB 3.41Å; M370-Q375 HydrophobicContact CE-CG 3.92Å; M370-Q375 PolarHBondContact O-N 3.01Å; M370-Q375 HydrophobicContact SD-CB 4.17Å; M370-Q375 HydrophobicContact SD-CG 4.32Å; L373-Q375 HydrophobicContact CB-CG 3.94Å; L373-Q375 PolarHBondContact O-N 3.36Å; L373-Q375 PolarHBondContact O-NE2 2.98Å; L373-Q375 VanDerWaalsContact O-NE2 3.1Å
376	T	97.1	Very high	97.5	Very high	32 Å²	32	38.2 Å²	38.2	20%	0.196	19%	0.193	C	C	.	.	S	Bend	trans	-151.7	166.8	171.4	-167.2	0	0	0	0	110	Y367 M370 V371 W395	Y367-T376 HydrophobicContact CD2-CG2 4.16Å; Y367-T376 HydrophobicContact CE2-CG2 3.88Å; M370-T376 HydrophobicContact CB-CG2 3.83Å; M370-T376 PolarHBondContact O-N 3.24Å; V371-T376 HydrophobicContact CG2-CG2 3.69Å; T376-W395 VanDerWaalsContact CB-CH2 3.49Å; T376-W395 HydrophobicContact CG2-CH2 3.67Å; T376-W395 HydrophobicContact CG2-CZ2 4.04Å; T376-W395 HydrophobicContact CG2-CZ3 4.14Å; T376-W395 WeakPolarHBondContact OG1-CH2 3.43Å
377	Q	96.8	Very high	97.3	Very high	143 Å²	143	38.4 Å²	38.4	67%	0.668	19%	0.193	S	C	*	.	P	Polyproline II helix	trans	-92.2	154.9	178.1	-63	-60.2	-40.2	0	0	111.8	Y367 E379	Y367-Q377 PolarHBondContact OH-O 2.81Å; Q377-E379 PolarHBondContact O-N 2.87Å
378	W	97.2	Very high	97.2	Very high	43 Å²	43	38 Å²	38	16%	0.163	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-70.3	125.7	170.1	179.1	-86.1	0	0	0	110.2	Q275 R278 R279 I282 Y367 V371 Y382	Q275-W378 HydrophobicContact CB-CZ2 4.34Å; Q275-W378 HydrophobicContact CG-CZ2 4.24Å; R278-W378 HydrophobicContact CB-CH2 3.92Å; R278-W378 HydrophobicContact CB-CZ3 4.5Å; R279-W378 HydrophobicContact CG-CD2 4.3Å; R279-W378 HydrophobicContact CG-CE3 4.47Å; R279-W378 HydrophobicContact CG-CH2 4.25Å; R279-W378 HydrophobicContact CG-CZ2 4.1Å; R279-W378 HydrophobicContact CG-CZ3 4.46Å; R279-W378 VanDerWaalsContact NH2-NE1 3.14Å; I282-W378 HydrophobicContact CD1-CE3 3.56Å; I282-W378 HydrophobicContact CD1-CH2 4.48Å; I282-W378 HydrophobicContact CD1-CZ3 3.35Å; Y367-W378 HydrophobicContact CE1-CE3 4.35Å; Y367-W378 HydrophobicContact CE1-CZ3 4.36Å; Y367-W378 WeakPolarHBondContact OH-CA 3.49Å; V371-W378 HydrophobicContact CG1-CB 4.15Å; V371-W378 HydrophobicContact CG1-CE3 4.39Å; W378-Y382 AromaticContact CH2-CD2 3.61Å; W378-Y382 HydrophobicContact CH2-CD2 3.61Å; W378-Y382 AromaticContact CH2-CE2 3.84Å; W378-Y382 HydrophobicContact CH2-CE2 3.84Å; W378-Y382 HydrophobicContact CZ2-CD2 4.13Å; W378-Y382 HydrophobicContact CZ3-CD2 4.25Å; W378-Y382 HydrophobicContact CZ3-CE2 4.15Å
379	E	96.7	Very high	97	Very high	69 Å²	69	39.7 Å²	39.7	32%	0.322	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-82.8	137.7	178.4	-69.8	-63.5	149.6	0	0	110.4	Y367 Q377 V381 L392	Y367-E379 PolarHBondContact OH-N 3.42Å; Q377-E379 PolarHBondContact O-N 2.87Å; E379-V381 VanDerWaalsContact CB-O 3.27Å; E379-V381 WeakPolarHBondContact CB-O 3.49Å; E379-V381 PolarHBondContact O-N 3.09Å; E379-L392 HydrophobicContact CG-CD1 3.77Å
380	T	94.8	Very high	96.7	Very high	113 Å²	113	46 Å²	46	69%	0.693	24%	0.235	S	C	*	.	S	Bend	trans	-62.3	-34.5	177.4	-60	0	0	0	0	111.3	Q275	Q275-T380 PolarHBondContact NE2-O 3.42Å
381	V	96.2	Very high	96.6	Very high	43 Å²	43	46 Å²	46	26%	0.261	24%	0.236	S	C	.	.	S	Bend	trans	-106.5	117.1	171	-178.5	0	0	0	0	107.9	I247 A248 P250 E379	I247-V381 WeakPolarHBondContact O-CG1 3.17Å; A248-V381 WeakPolarHBondContact O-CG1 3.32Å; P250-V381 HydrophobicContact CG-CG1 4.25Å; P250-V381 HydrophobicContact CG-CG2 3.88Å; E379-V381 VanDerWaalsContact CB-O 3.27Å; E379-V381 WeakPolarHBondContact CB-O 3.49Å; E379-V381 PolarHBondContact O-N 3.09Å
382	Y	97.6	Very high	96.5	Very high	9 Å²	9	48.6 Å²	48.6	4%	0.035	25%	0.248	C	C	.	.			trans	-59.2	128.9	-177.1	-168.6	-79.5	0	0	0	110.6	I247 M274 R278 I353 T365 Y367 E368 W378 M384	I247-Y382 HydrophobicContact CG2-CD1 4.26Å; I247-Y382 HydrophobicContact CG2-CG 4.43Å; M274-Y382 HydrophobicContact CE-CD1 4.5Å; M274-Y382 HydrophobicContact CE-CD2 4.31Å; M274-Y382 HydrophobicContact CE-CG 3.93Å; M274-Y382 HydrophobicContact SD-CD2 4.18Å; M274-Y382 HydrophobicContact SD-CG 4.4Å; R278-Y382 HydrophobicContact CG-CE2 4.43Å; I353-Y382 HydrophobicContact CD1-CD1 4.34Å; I353-Y382 HydrophobicContact CD1-CE1 3.62Å; I353-Y382 HydrophobicContact CG1-CE1 4.03Å; T365-Y382 PolarHBondContact OG1-OH 3.1Å; Y367-Y382 HydrophobicContact CD1-CE2 4.25Å; Y367-Y382 HydrophobicContact CE1-CE2 4.31Å; E368-Y382 VanDerWaalsContact CD-OH 3.25Å; E368-Y382 HydrophobicContact CG-CE2 4.24Å; E368-Y382 PolarHBondContact OE1-OH 3.23Å; W378-Y382 AromaticContact CH2-CD2 3.61Å; W378-Y382 HydrophobicContact CH2-CD2 3.61Å; W378-Y382 AromaticContact CH2-CE2 3.84Å; W378-Y382 HydrophobicContact CH2-CE2 3.84Å; W378-Y382 HydrophobicContact CZ2-CD2 4.13Å; W378-Y382 HydrophobicContact CZ3-CD2 4.25Å; W378-Y382 HydrophobicContact CZ3-CE2 4.15Å; Y382-M384 HydrophobicContact CD1-SD 4.02Å; Y382-M384 HydrophobicContact CE1-SD 4.37Å; Y382-M384 PolarHBondContact O-N 3.11Å
383	P	97.4	Very high	96.4	Very high	10 Å²	10	48.2 Å²	48.2	7%	0.065	25%	0.246	C	C	.	.			trans	-72.5	124.1	-174.2	28.3	-33.9	0	0	0	111.9	Y367 L392	Y367-P383 HydrophobicContact CD1-CG 3.63Å; Y367-P383 HydrophobicContact CD2-CG 4.15Å; Y367-P383 HydrophobicContact CE1-CG 3.61Å; Y367-P383 HydrophobicContact CE2-CG 4.13Å; Y367-P383 HydrophobicContact CG-CG 3.91Å; P383-L392 HydrophobicContact CB-CD1 3.57Å; P383-L392 HydrophobicContact CB-CG 4.46Å; P383-L392 HydrophobicContact CG-CD1 3.99Å
384	M	97.9	Very high	96.3	Very high	9 Å²	9	50.9 Å²	50.9	4%	0.044	26%	0.264	C	S	.	.			trans	-110	64.5	170.8	-59.7	-57.5	-69.8	0	0	108.6	G219 T221 A222 A244 I247 A248 I353 Y382	G219-M384 WeakPolarHBondContact O-CE 3.46Å; T221-M384 CarbonylContact C-O 3.32Å; T221-M384 WeakPolarHBondContact CA-O 2.93Å; A222-M384 HydrophobicContact CB-CB 4.12Å; A222-M384 PolarHBondContact N-O 3.41Å; A244-M384 HydrophobicContact CB-CE 3.64Å; I247-M384 HydrophobicContact CB-CG 3.97Å; I247-M384 HydrophobicContact CB-SD 4.25Å; I247-M384 HydrophobicContact CD1-CE 4.34Å; I247-M384 HydrophobicContact CD1-SD 4.26Å; I247-M384 HydrophobicContact CG2-CG 3.6Å; I247-M384 HydrophobicContact CG2-SD 3.7Å; A248-M384 HydrophobicContact CB-CB 4.22Å; A248-M384 HydrophobicContact CB-CG 4.25Å; I353-M384 HydrophobicContact CD1-CE 4.27Å; I353-M384 HydrophobicContact CD1-SD 3.98Å; Y382-M384 HydrophobicContact CD1-SD 4.02Å; Y382-M384 HydrophobicContact CE1-SD 4.37Å; Y382-M384 PolarHBondContact O-N 3.11Å
385	D	97.3	Very high	96.4	Very high	24 Å²	24	44 Å²	44	13%	0.128	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-131.1	18.8	-166.9	71.7	-20.5	0	0	0	113.1	Y387 A388 S391 L392	D385-Y387 PolarHBondContact O-N 3.32Å; D385-A388 HydrophobicContact CB-CB 3.83Å; D385-A388 WeakPolarHBondContact O-CB 3.38Å; D385-A388 PolarHBondContact O-N 2.83Å; D385-S391 WeakPolarHBondContact O-CB 3.43Å; D385-S391 VanDerWaalsContact OD2-CA 3.27Å; D385-S391 WeakPolarHBondContact OD2-CA 3.48Å; D385-L392 WeakPolarHBondContact OD2-CG 3.33Å; D385-L392 PolarHBondContact OD2-N 3.06Å
386	Y	96.8	Very high	96.4	Very high	13 Å²	13	40.3 Å²	40.3	5%	0.051	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-28.3	-167	-168.9	-125.2	0	0	0	114.8	C220 I306 A347 P349 P366 N397	C220-Y386 HydrophobicContact CB-CD1 4.36Å; C220-Y386 WeakPolarHBondContact O-CB 3.17Å; C220-Y386 PolarHBondContact O-N 2.81Å; I306-Y386 HydrophobicContact CD1-CE2 4.35Å; A347-Y386 VanDerWaalsContact O-CE1 3.24Å; A347-Y386 WeakPolarHBondContact O-CE1 3.28Å; A347-Y386 PolarHBondContact O-OH 2.92Å; P349-Y386 HydrophobicContact CG-CD1 3.45Å; P349-Y386 VanDerWaalsContact CG-CD1 3.45Å; P349-Y386 HydrophobicContact CG-CD2 3.99Å; P349-Y386 HydrophobicContact CG-CE1 3.9Å; P349-Y386 HydrophobicContact CG-CE2 4.41Å; P349-Y386 HydrophobicContact CG-CG 3.49Å; P349-Y386 VanDerWaalsContact CG-CG 3.49Å; P366-Y386 HydrophobicContact CG-CE2 4.41Å; Y386-N397 WeakPolarHBondContact CD1-ND2 3.36Å; Y386-N397 WeakPolarHBondContact CE1-ND2 3.43Å; Y386-N397 VanDerWaalsContact CZ-ND2 3.33Å; Y386-N397 WeakPolarHBondContact O-CB 3.5Å; Y386-N397 PolarHBondContact O-N 3.14Å
387	Y	95.7	Very high	96.2	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.027	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	10	171.3	-71.8	-87.1	0	0	0	112.7	L140 I141 P211 T221 D385 N397 N398	L140-Y387 HydrophobicContact CD1-CD1 4Å; L140-Y387 HydrophobicContact CD1-CD2 4.39Å; L140-Y387 HydrophobicContact CD1-CG 3.81Å; L140-Y387 HydrophobicContact CD2-CD1 4.1Å; L140-Y387 HydrophobicContact CD2-CD2 3.83Å; L140-Y387 HydrophobicContact CD2-CE1 4.08Å; L140-Y387 HydrophobicContact CD2-CE2 3.8Å; L140-Y387 HydrophobicContact CD2-CG 3.97Å; L140-Y387 HydrophobicContact CG-CD1 3.83Å; L140-Y387 HydrophobicContact CG-CD2 4.37Å; L140-Y387 HydrophobicContact CG-CE1 4.07Å; L140-Y387 HydrophobicContact CG-CG 3.99Å; I141-Y387 HydrophobicContact CG1-CE1 4.32Å; P211-Y387 WeakPolarHBondContact CD-O 3.26Å; T221-Y387 PolarHBondContact OG1-N 2.89Å; D385-Y387 PolarHBondContact O-N 3.32Å; Y387-N397 HydrophobicContact CD1-CB 3.53Å; Y387-N397 HydrophobicContact CE1-CB 3.61Å; Y387-N397 VanDerWaalsContact CE1-CG 3.48Å; Y387-N397 WeakPolarHBondContact CE1-ND2 3.49Å; Y387-N397 HydrophobicContact CG-CB 4.25Å; Y387-N397 VanDerWaalsContact CZ-ND2 3.29Å; Y387-N398 PolarHBondContact O-ND2 2.84Å
388	A	95.6	Very high	96.1	Very high	2 Å²	2	33.3 Å²	33.3	2%	0.017	18%	0.18	C	C	.	.			trans	-68.9	140.1	176.6	0	0	0	0	0	110.8	K210 T221 D385 D390 S391	K210-A388 CarbonylContact O-C 3.54Å; K210-A388 WeakPolarHBondContact O-CA 3.31Å; T221-A388 HydrophobicContact CG2-CB 4.14Å; D385-A388 HydrophobicContact CB-CB 3.83Å; D385-A388 WeakPolarHBondContact O-CB 3.38Å; D385-A388 PolarHBondContact O-N 2.83Å; A388-D390 VanDerWaalsContact C-N 3.28Å; A388-D390 PolarHBondContact O-N 3.35Å; A388-S391 VanDerWaalsContact O-CB 3.25Å; A388-S391 WeakPolarHBondContact O-CB 3.47Å; A388-S391 PolarHBondContact O-N 2.85Å; A388-S391 PolarHBondContact O-OG 2.71Å
389	N	94.6	Very high	95.9	Very high	35 Å²	35	35.1 Å²	35.1	19%	0.187	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-27.3	176.8	-69.8	-21.6	0	0	0	112.5	K210 M402	K210-N389 HydrophobicContact CB-CB 4.29Å; K210-N389 VanDerWaalsContact CB-ND2 3.35Å; K210-N389 WeakPolarHBondContact CB-ND2 3.48Å; K210-N389 PolarHBondContact O-N 3.34Å; N389-M402 HydrophobicContact CB-CG 4.04Å; N389-M402 HydrophobicContact CB-SD 3.58Å; N389-M402 VanDerWaalsContact CB-SD 3.58Å; N389-M402 PolarHBondContact ND2-SD 3.01Å
390	D	93.9	Very high	95.5	Very high	133 Å²	133	34 Å²	34	71%	0.711	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.6	31.1	175	59.7	-30.4	0	0	0	112.3	A388	A388-D390 VanDerWaalsContact C-N 3.28Å; A388-D390 PolarHBondContact O-N 3.35Å
391	S	96	Very high	94.9	Very high	7 Å²	7	34.4 Å²	34.4	5%	0.049	19%	0.189	C	C	.	.			trans	-62.4	148.4	178.3	40	0	0	0	0	113.7	D385 A388 G393 T396 H399	D385-S391 WeakPolarHBondContact O-CB 3.43Å; D385-S391 VanDerWaalsContact OD2-CA 3.27Å; D385-S391 WeakPolarHBondContact OD2-CA 3.48Å; A388-S391 VanDerWaalsContact O-CB 3.25Å; A388-S391 WeakPolarHBondContact O-CB 3.47Å; A388-S391 PolarHBondContact O-N 2.85Å; A388-S391 PolarHBondContact O-OG 2.71Å; S391-G393 VanDerWaalsContact C-N 3.31Å; S391-G393 PolarHBondContact O-N 3.36Å; S391-T396 WeakPolarHBondContact CB-OG1 3.49Å; S391-T396 PolarHBondContact OG-OG1 3.4Å; S391-H399 PolarHBondContact O-ND1 2.63Å; S391-H399 WeakPolarHBondContact OG-CA 3.22Å; S391-H399 PolarHBondContact OG-N 3.24Å
392	L	95.3	Very high	93.3	Very high	70 Å²	70	37.7 Å²	37.7	37%	0.366	20%	0.203	S	C	.	.	S	Bend	trans	-63.9	-27.7	-170.7	-68.9	-178.6	0	0	0	114.7	E379 P383 D385 W395	E379-L392 HydrophobicContact CG-CD1 3.77Å; P383-L392 HydrophobicContact CB-CD1 3.57Å; P383-L392 HydrophobicContact CB-CG 4.46Å; P383-L392 HydrophobicContact CG-CD1 3.99Å; D385-L392 WeakPolarHBondContact OD2-CG 3.33Å; D385-L392 PolarHBondContact OD2-N 3.06Å; L392-W395 HydrophobicContact CB-CZ2 4.06Å
393	G	96.4	Very high	90.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.01	24%	0.241	C	C	.	.	S	Bend	trans	-167.4	172.7	-174.1	0	0	0	0	0	115.6	S391 W395 T396 H399	S391-G393 VanDerWaalsContact C-N 3.31Å; S391-G393 PolarHBondContact O-N 3.36Å; G393-W395 PolarHBondContact O-N 3.21Å; G393-T396 PolarHBondContact O-N 3.17Å; G393-T396 PolarHBondContact O-OG1 3.23Å; G393-H399 VanDerWaalsContact O-CB 3.23Å; G393-H399 WeakPolarHBondContact O-CB 3.49Å; G393-H399 VanDerWaalsContact O-CG 3.31Å
394	P	96.6	Very high	88.1	Confident	64 Å²	64	52.8 Å²	52.8	42%	0.416	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-0.6	-173.3	29.9	-37.7	0	0	0	114.2	L309 T396	L309-P394 HydrophobicContact CD2-CB 3.88Å; L309-P394 HydrophobicContact CD2-CG 3.91Å; L309-P394 WeakPolarHBondContact CD2-O 3.42Å; P394-T396 PolarHBondContact O-N 3.33Å
395	W	97	Very high	85.2	Confident	13 Å²	13	61.5 Å²	61.5	5%	0.049	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	10	172.8	56.7	78.1	0	0	0	113.4	P366 Y367 M370 T376 L392 G393	P366-W395 HydrophobicContact CB-CB 3.74Å; P366-W395 WeakPolarHBondContact CB-O 3.38Å; Y367-W395 AromaticContact CD2-CE2 3.81Å; Y367-W395 AromaticContact CD2-CZ2 3.86Å; Y367-W395 HydrophobicContact CD2-CZ2 3.86Å; Y367-W395 AromaticContact CD2-NE1 3.64Å; Y367-W395 HydrophobicContact CE2-CZ2 4.35Å; M370-W395 HydrophobicContact CB-CD2 4.35Å; M370-W395 HydrophobicContact CB-CE3 3.93Å; M370-W395 HydrophobicContact CB-CZ3 4.18Å; M370-W395 HydrophobicContact CE-CE3 3.89Å; M370-W395 HydrophobicContact CE-CZ3 4.1Å; M370-W395 HydrophobicContact CG-CB 4.19Å; M370-W395 HydrophobicContact CG-CD2 4.02Å; M370-W395 HydrophobicContact CG-CE3 3.58Å; M370-W395 HydrophobicContact CG-CG 4.31Å; M370-W395 HydrophobicContact CG-CZ3 4.27Å; T376-W395 VanDerWaalsContact CB-CH2 3.49Å; T376-W395 HydrophobicContact CG2-CH2 3.67Å; T376-W395 HydrophobicContact CG2-CZ2 4.04Å; T376-W395 HydrophobicContact CG2-CZ3 4.14Å; T376-W395 WeakPolarHBondContact OG1-CH2 3.43Å; L392-W395 HydrophobicContact CB-CZ2 4.06Å; G393-W395 PolarHBondContact O-N 3.21Å
396	T	96.9	Very high	82	Confident	6 Å²	6	65.7 Å²	65.7	4%	0.037	34%	0.341	C	S	.	.	S	Bend	trans	-119.6	164	178.3	65.7	0	0	0	0	111	S391 G393 P394 N398 H399	S391-T396 WeakPolarHBondContact CB-OG1 3.49Å; S391-T396 PolarHBondContact OG-OG1 3.4Å; G393-T396 PolarHBondContact O-N 3.17Å; G393-T396 PolarHBondContact O-OG1 3.23Å; P394-T396 PolarHBondContact O-N 3.33Å; T396-N398 PolarHBondContact O-N 2.87Å; T396-H399 WeakPolarHBondContact OG1-CB 2.84Å
397	N	94.2	Very high	79	Confident	12 Å²	12	76.2 Å²	76.2	6%	0.064	38%	0.381	C	S	.	.	S	Bend	trans	-72.8	-29.8	-169.7	-80.2	-67.7	0	0	0	115	N303 Y386 Y387 K401	N303-N397 WeakPolarHBondContact CB-OD1 3.39Å; N303-N397 PolarHBondContact ND2-OD1 2.75Å; Y386-N397 WeakPolarHBondContact CD1-ND2 3.36Å; Y386-N397 WeakPolarHBondContact CE1-ND2 3.43Å; Y386-N397 VanDerWaalsContact CZ-ND2 3.33Å; Y386-N397 WeakPolarHBondContact O-CB 3.5Å; Y386-N397 PolarHBondContact O-N 3.14Å; Y387-N397 HydrophobicContact CD1-CB 3.53Å; Y387-N397 HydrophobicContact CE1-CB 3.61Å; Y387-N397 VanDerWaalsContact CE1-CG 3.48Å; Y387-N397 WeakPolarHBondContact CE1-ND2 3.49Å; Y387-N397 HydrophobicContact CG-CB 4.25Å; Y387-N397 VanDerWaalsContact CZ-ND2 3.29Å; N397-K401 WeakPolarHBondContact O-CE 3.38Å; N397-K401 PolarHBondContact O-NZ 2.65Å
398	N	93.4	Very high	76.2	Confident	17 Å²	17	82 Å²	82	9%	0.091	42%	0.417	C	S	.	.	S	Bend	trans	-114.9	2	-170.6	-73.4	-24	0	0	0	114.5	Y387 T396 G400 K401	Y387-N398 PolarHBondContact O-ND2 2.84Å; T396-N398 PolarHBondContact O-N 2.87Å; N398-G400 PolarHBondContact O-N 3.34Å; N398-K401 PolarHBondContact O-N 2.93Å
399	H	93.4	Very high	73.1	Confident	81 Å²	81	87 Å²	87	38%	0.375	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	131.8	177.8	-173.2	79.1	0	0	0	111.9	S391 G393 T396 K401	S391-H399 PolarHBondContact O-ND1 2.63Å; S391-H399 WeakPolarHBondContact OG-CA 3.22Å; S391-H399 PolarHBondContact OG-N 3.24Å; G393-H399 VanDerWaalsContact O-CB 3.23Å; G393-H399 WeakPolarHBondContact O-CB 3.49Å; G393-H399 VanDerWaalsContact O-CG 3.31Å; T396-H399 WeakPolarHBondContact OG1-CB 2.84Å; H399-K401 PolarHBondContact O-N 3.42Å; H399-K401 VanDerWaalsContact O-N 3.09Å
400	G	88.1	Confident	70.2	Confident	45 Å²	45	90.8 Å²	90.8	46%	0.464	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	-12.9	178.9	0	0	0	0	0	116.4	N398 M402 M403	N398-G400 PolarHBondContact O-N 3.34Å; G400-M402 VanDerWaalsContact C-N 3.34Å; G400-M402 PolarHBondContact O-N 3.26Å; G400-M403 PolarHBondContact O-N 3.32Å
401	K	82	Confident	67.2	Low	122 Å²	122	92.5 Å²	92.5	53%	0.53	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-69.6	-24.7	-174.3	-68.7	-174.5	-179.7	163.8	0	114.5	N397 N398 H399	N397-K401 WeakPolarHBondContact O-CE 3.38Å; N397-K401 PolarHBondContact O-NZ 2.65Å; N398-K401 PolarHBondContact O-N 2.93Å; H399-K401 PolarHBondContact O-N 3.42Å; H399-K401 VanDerWaalsContact O-N 3.09Å
402	M	63.2	Low	64.8	Low	112 Å²	112	102 Å²	102	55%	0.552	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-89.5	-5.5	-177.8	-80.2	-153.5	70.7	0	0	115.2	N389 G400 H404	N389-M402 HydrophobicContact CB-CG 4.04Å; N389-M402 HydrophobicContact CB-SD 3.58Å; N389-M402 VanDerWaalsContact CB-SD 3.58Å; N389-M402 PolarHBondContact ND2-SD 3.01Å; G400-M402 VanDerWaalsContact C-N 3.34Å; G400-M402 PolarHBondContact O-N 3.26Å; M402-H404 PolarHBondContact O-N 2.71Å; M402-H404 VanDerWaalsContact O-N 3.14Å
403	M	48.3	Very low	62.3	Low	167 Å²	167	105 Å²	105	82%	0.823	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-70.8	-4.1	179.2	-70.2	-74.6	-174.5	0	0	113.7	G400	G400-M403 PolarHBondContact O-N 3.32Å
404	H	37.9	Very low	59.9	Low	169 Å²	169	114 Å²	114	78%	0.782	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-128	26.9	-170	-81.4	-40.6	0	0	0	118	M402 P406	M402-H404 PolarHBondContact O-N 2.71Å; M402-H404 VanDerWaalsContact O-N 3.14Å; H404-P406 WeakPolarHBondContact O-CD 3.11Å
405	K	36.8	Very low	58.1	Low	191 Å²	191	116.5 Å²	116.5	83%	0.83	60%	0.599	S	S	*	*			trans	-102.2	104.6	162.6	-78.1	-170.1	178	-179	0	111	R407	K405-R407 PolarHBondContact O-N 2.92Å
406	P	30.5	Very low	56	Low	113 Å²	113	121.9 Å²	121.9	73%	0.734	63%	0.628	S	S	*	*			trans	-61.5	129.2	167.5	26.2	-30.6	0	0	0	108	H404 V408	H404-P406 WeakPolarHBondContact O-CD 3.11Å; P406-V408 PolarHBondContact O-N 2.93Å
407	R	34.3	Very low	53.7	Low	233 Å²	233	128.3 Å²	128.3	88%	0.879	66%	0.66	S	S	*	*			trans	-58.3	106.1	167.8	-88.9	-179.4	171.8	170.5	-2.7	107.5	K405 T409	K405-R407 PolarHBondContact O-N 2.92Å; R407-T409 VanDerWaalsContact C-N 3.29Å; R407-T409 PolarHBondContact O-N 2.65Å
408	V	35	Very low	51.4	Low	129 Å²	129	135.2 Å²	135.2	78%	0.782	70%	0.696	S	S	*	*			trans	-64.7	99	161.5	-179.8	0	0	0	0	105.9	P406 I410	P406-V408 PolarHBondContact O-N 2.93Å; V408-I410 HydrophobicContact CG1-CG1 4.32Å; V408-I410 PolarHBondContact O-N 2.8Å
409	T	30.9	Very low	48.7	Very low	107 Å²	107	142.6 Å²	142.6	66%	0.656	73%	0.733	S	S	*	*			trans	-80.9	103.7	171	-54.4	0	0	0	0	105.8	R407 Q411	R407-T409 VanDerWaalsContact C-N 3.29Å; R407-T409 PolarHBondContact O-N 2.65Å; T409-Q411 HydrophobicContact CG2-CG 4.44Å; T409-Q411 PolarHBondContact O-N 3.35Å
410	I	35	Very low	45.8	Very low	115 Å²	115	146.7 Å²	146.7	59%	0.59	76%	0.757	S	S	*	*			trans	-71.4	100.1	168.9	-58.4	175.4	0	0	0	106	V408 Y412	V408-I410 HydrophobicContact CG1-CG1 4.32Å; V408-I410 PolarHBondContact O-N 2.8Å; I410-Y412 HydrophobicContact CB-CE2 4.49Å; I410-Y412 HydrophobicContact CG2-CD2 4.17Å; I410-Y412 HydrophobicContact CG2-CE1 4.35Å; I410-Y412 HydrophobicContact CG2-CE2 3.82Å; I410-Y412 PolarHBondContact O-N 2.92Å
411	Q	30.9	Very low	42.7	Very low	169 Å²	169	153.9 Å²	153.9	79%	0.79	78%	0.778	S	S	*	*			trans	-76.7	112.9	164	-76.3	-176.3	-27.6	0	0	107.5	T409 T413	T409-Q411 HydrophobicContact CG2-CG 4.44Å; T409-Q411 PolarHBondContact O-N 3.35Å; Q411-T413 PolarHBondContact O-N 3.18Å
412	Y	43.8	Very low	39.7	Very low	206 Å²	206	156.4 Å²	156.4	81%	0.808	80%	0.797	S	S	*	*			trans	-77	112.2	162	-66.2	-86.6	0	0	0	107	I410	I410-Y412 HydrophobicContact CB-CE2 4.49Å; I410-Y412 HydrophobicContact CG2-CD2 4.17Å; I410-Y412 HydrophobicContact CG2-CE1 4.35Å; I410-Y412 HydrophobicContact CG2-CE2 3.82Å; I410-Y412 PolarHBondContact O-N 2.92Å
413	T	42.8	Very low	37.8	Very low	132 Å²	132	160.1 Å²	160.1	81%	0.81	82%	0.818	S	S	*	*			trans	-69.3	132.6	162.9	47.3	0	0	0	0	108.5	Q411	Q411-T413 PolarHBondContact O-N 3.18Å
414	S	47.1	Very low	36.8	Very low	190 Å²	190	159.5 Å²	159.5	100%	1.329	82%	0.817	S	S	*	*			trans	-48.1	0	178	54.2	0	0	0	0	114.8

Retrieved 414 of 414 residues in 163.4 ms (Link to these results)

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